3614 SMILES Strings for E3 ubiquitin-protein ligase Mdm2

Compound Name
SMILES String
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cn(C)c(=O)n(C)c2=O)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cn(C)c2=O)c(OC)n1
CN(C)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)ccc21 |r|
COc1ccc(C2=NC(C(N2C(=O)N2CCNC(=O)C2)c2ccc(Cl)cc2)c2ccc(Cl)cc2)c(OC(C)C)c1 |t:6|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CN(C)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CN(C)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1ccc(F)c(Cl)c1)C(=O)Nc1cc(Cl)ccc21 |r|
CN(C)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cc(F)cc(Cl)c1)C(=O)Nc1cc(Cl)ccc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CC(C)(C)C[C@@H]1N[C@@H]([C@@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCCCC1 |r|
Cc1ccc2ccc(C(Nc3ccccc3)c3ccccc3)c(O)c2n1
OC(=O)[C@H](Cc1c[nH]c2cc(Br)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)CCC2CCCC2)c2cc(Br)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)OCc2ccccc2)c2cc(Br)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(Cc2ccc(OCc3ccccc3)cc2)c2cc(Br)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1c[nH]c2cc(Cl)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)CCC2CCCC2)c2cc(Cl)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)OCc2ccccc2)c2cc(Cl)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(Cc2ccc(OCc3ccccc3)cc2)c2cc(Cl)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)CCC2CCCC2)c2cc(F)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)OCc2ccccc2)c2cc(F)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(Cc2ccc(OCc3ccccc3)cc2)c2cc(F)ccc12)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1c[nH]c2ccc(cc12)C#N)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)CCC2CCCC2)c2ccc(cc12)C#N)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(C(=O)OCc2ccccc2)c2ccc(cc12)C#N)NC(=O)c1ccccc1Oc1ccccc1 |r|
OC(=O)[C@H](Cc1cn(Cc2ccc(OCc3ccccc3)cc2)c2ccc(cc12)C#N)NC(=O)c1ccccc1Oc1ccccc1 |r|
Cc1ccc2[nH]cc(C[C@H](NC(=O)c3ccccc3Oc3ccccc3)C(O)=O)c2c1 |r|
Cc1ccc2n(cc(C[C@H](NC(=O)c3ccccc3Oc3ccccc3)C(O)=O)c2c1)C(=O)CCC1CCCC1 |r|
Cc1ccc2n(cc(C[C@H](NC(=O)c3ccccc3Oc3ccccc3)C(O)=O)c2c1)C(=O)OCc1ccccc1 |r|
Cc1ccc2n(Cc3ccc(OCc4ccccc4)cc3)cc(C[C@H](NC(=O)c3ccccc3Oc3ccccc3)C(O)=O)c2c1 |r|
CC(C)(C)c1ccc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)cc1
CCCOC1(N(C(Cc2ccc(O)cc2)C(=O)OC)C(=O)c2ccccc12)c1ccccc1
OC[C@H](NC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1)[C@@H](O)c1ccccc1 |r|
CCCN1C(=O)c2ccccc2C1(NC(=O)c1ccc(cc1)C(C)(C)C)c1ccc(OCOCC[Si](C)(C)C)cc1
CCCN1C(=O)c2ccccc2C1(NC(=O)c1ccccc1)c1ccc(cc1)C(C)(C)C
COc1ccc(cc1)C(O)CNC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
[O-][N+](=O)c1cccc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)c1
O=C1CCCN1CCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
C=CC(=O)OCCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
CCCCc1ncc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)[nH]1
Oc1ccc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)cc1
COc1ccc(CCOC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)cc1OC
CC(=O)NCCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
O=C1N(Cc2ccccc2)C(OCCN2CCNCC2)(c2ccccc12)c1ccccc1
Oc1cccc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)c1
[O-][N+](=O)c1cc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)ccc1Cl
Oc1ccccc1OCCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
CC(C)(C)c1ccc(COC2(N(CCc3cnc[nH]3)C(=O)c3ccccc23)c2ccccc2)cc1
O=Cc1ccc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)o1
Oc1ccc(C(=O)NCCOC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)c(O)c1
O=C1N(Cc2ccccc2)C(OCCNc2ccccc2)(c2ccccc12)c1ccccc1
Cc1cccc(c1)N(CCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1)CCC#N
CN(CCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1)c1ccc(C=O)cc1
Cc1ccc(c(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)c1)[N+]([O-])=O
COc1cc(COC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccccc2)cc(OC)c1O
[O-]S(=O)(=O)CCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
COc1ccc(cc1)[C@@H](O)COC1(N(CCCO)C(=O)c2ccccc12)c1ccccc1 |r|
COCCOC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
COC(=O)COC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccccc1
COc1ccc(cc1)[C@@H](O)COC1(N(Cc2ccco2)C(=O)c2ccccc12)c1ccccc1 |r|
CCCOC1(N(Cc2ccc(OC)cc2)C(=O)c2ccccc12)c1ccccc1
COC(=O)C(Cc1ccc(O)cc1)N1C(=O)c2ccccc2C1(OCCN(CCC#N)c1ccccc1)c1ccccc1
COC(=O)C(Cc1ccc(O)cc1)N1C(=O)c2ccccc2C1(OCCn1c(C)ncc1[N+]([O-])=O)c1ccccc1
COC(=O)C(Cc1ccc(O)cc1)N1C(=O)c2ccccc2C1(OCCOC(C)=O)c1ccccc1
CCCOC1(N(CCO)C(=O)c2ccccc12)c1ccccc1
CCCOC1(N(CCCC(OC)OC)C(=O)c2ccccc12)c1ccccc1
CCCN1C(=O)c2ccccc2C1(OCCS(C)(=O)=O)c1ccc(cc1)C(C)(C)C
CCCN1C(=O)c2ccccc2C1(OCCNC(=O)c1ccccc1O)c1ccc(cc1)C(C)(C)C
CCCN1C(=O)c2ccccc2C1(OCc1cc2OCOc2cc1[N+]([O-])=O)c1ccc(cc1)C(C)(C)C
CCCN1C(=O)c2ccccc2C1(OCCc1ccc(O)cc1)c1ccc(cc1)C(C)(C)C
CCCN1C(=O)c2ccccc2C1(OCCN1CCNC1=O)c1ccc(cc1)C(C)(C)C
CCCN1C(=O)c2ccccc2C1(OCc1[nH]cnc1C)c1ccc(cc1)C(C)(C)C
CCCN1C(=O)c2ccccc2C1(OCc1cc(c(C)c(c1)[N+]([O-])=O)[N+]([O-])=O)c1ccc(OCOCC[Si](C)(C)C)cc1
CC(=O)NCCN1C(=O)c2ccccc2C1(OCc1ccc(cc1)C(C)(C)C)c1ccccc1
CC(=C)C(=O)OCCN1C(=O)c2ccccc2C1(N[C@@H](CO)[C@@H](O)c1ccccc1)c1ccccc1 |r|
c1ccc(cc1)C(N=Nc1nc2ccccc2s1)c1ccccn1 |w:7.7|
OC(=O)COc1ccc(\C=C\C(=O)c2ccc(Cl)cc2)cc1
OC(=O)COc1ccc(\C=C\C(=O)c2ccc(Cl)c(Cl)c2)cc1
OC(=O)COc1ccc(cc1)C(=O)\C=C\c1ccc(Cl)c(Cl)c1
CC(C)(Oc1ccc(\C=C\C(=O)c2ccc(Cl)cc2)cc1)C(O)=O
Oc1ccc2ccc3OCN(Cc4ccccc4)Cc3c2c1
CCOC(=O)C(C)(C)Oc1ccc(CCNC(=O)\C=C\C(=O)c2ccc(Cl)cc2)cc1
O=C(CC(=Nc1ccccc1)c1ccccc1)Nc1ccccc1 |w:4.4|
CCOc1ccc(NC(=O)CC(=Nc2ccccc2)c2ccccc2)cc1 |w:12.12|
O=C(C(C=Nc1ccccc1)c1ccccc1)C(=S)Nc1ccccc1 |w:3.2|
CCC(C)Cc1ccc(OCC(O)=O)c(Cl)c1Cl
OC(=O)COc1c(Br)cc(\C=C\C(=O)c2ccc3ccccc3c2)cc1Br
CC(C)Oc1ccc(cc1)C(=O)NS(=O)(=O)c1ccc(cc1)N=Nc1c(O)n(-c2ccccc2)n(-c2ccccc2)c1=O |w:23.25|
OC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OC(=O)[C@H](N1[C@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
Nc1cc(Cl)ccc1CN1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1N |r|
COCCOCCN1c2ccc(I)cc2C(=O)N([C@H](C)c2ccc(Cl)cc2N)[C@@H](c2ccc(Cl)cc2)C1=O |r|
COCCOCCN1c2ccc(I)cc2C(=O)N(Cc2ccc(Cl)cc2O)[C@@H](c2ccc(Cl)cc2)C1=O |r|
COCCOCCN1c2ccc(I)cc2C(=O)N(Cc2ccc(Cl)cc2OCC=C)[C@@H](c2ccc(Cl)cc2)C1=O |r|
COCCOCCN1c2ccc(I)cc2C(=O)N(Cc2ccc(Cl)nc2N)[C@@H](c2ccc(Cl)cc2)C1=O |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1N |r|
Nc1cc(Cl)ccc1CN1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCN2CCOCC2)c2ccc(I)cc2C1=O |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O)c1cc(F)c(Cl)cc1N |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O)c1cc(O)c(Cl)cc1N |r|
Fc1cc(Cl)ccc1CN1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O |r|
Nc1cc(ccc1Cl)C1(CC1)N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O |r|
Cc1cc(Cl)ccc1CN1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O |r|
CN(C)CCCCN1c2ccc(I)cc2C(=O)N(Cc2ccc(Cl)cc2N)[C@@H](c2ccc(Cl)cc2)C1=O |r|
CN(C)CCCN1c2ccc(I)cc2C(=O)N(Cc2ccc(Cl)cc2N)[C@@H](c2ccc(Cl)cc2)C1=O |r|
CN1CCN(CCCN2c3ccc(I)cc3C(=O)N(Cc3ccc(Cl)cc3N)[C@@H](c3ccc(Cl)cc3)C2=O)CC1 |r|
CN1CCN(CCCCN2c3ccc(I)cc3C(=O)N(Cc3ccc(Cl)cc3N)[C@@H](c3ccc(Cl)cc3)C2=O)CC1 |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
C[C@H](N1[C@H](c2ccc(Cl)cc2)C(=O)N(CCN2CCOCC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1N |r|
COCCOCCN1c2ccc(I)cc2C(=O)N([C@H](C)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
COCCOCCN1c2ccc(I)cc2C(=O)N([C@@H](C)c2ccc(Cl)cc2)[C@H](c2ccc(Cl)cc2)C1=O |r|
CC#Cc1ccc2N(CCN3CCOCC3)C(=O)[C@@H](N([C@H](C)c3ccc(Cl)cc3N)C(=O)c2c1)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCN2CCN(C)CC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1N |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CC(=O)N2CCOCC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CC(=O)N2CCNCC2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1N |r|
OC(=O)C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OCCNC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OC(=O)CCNC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OC(=O)CCCCNC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
CN(C)CCNC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
CN1c2ccc(I)cc2C(=O)N([C@H](C(O)=O)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
CNC(=O)CN1c2ccc(I)cc2C(=O)N([C@H](C(O)=O)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
OC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(Cc2ccncc2)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OC(=O)CN1c2ccc(I)cc2C(=O)N([C@H](C(O)=O)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
OC(=O)CCN1c2ccc(I)cc2C(=O)N([C@H](C(O)=O)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
OC(=O)CCCCN1c2ccc(I)cc2C(=O)N([C@H](C(O)=O)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
CN(C)CCN1c2ccc(I)cc2C(=O)N([C@H](C(O)=O)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
COC(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
CCN(CC)C(=O)[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OC(=O)CCCCN1c2ccc(I)cc2C(=O)N(Cc2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
C[C@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
OC(=O)CCCCN1c2ccc(I)cc2C(=O)N([C@H](C2CC2)c2ccc(Cl)cc2)[C@@H](c2ccc(Cl)cc2)C1=O |r|
C[C@@H](N1[C@@H](c2ccc(cc2)C(F)(F)F)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@@H](c2ccc(OC(F)(F)F)cc2)C(=O)N(CCCCC(O)=O)c2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)c2ccc(cc2C1=O)C#C)c1ccc(Cl)cc1 |r|
CC#Cc1ccc2N(CCCCC(O)=O)C(=O)[C@@H](N([C@H](C)c3ccc(Cl)cc3)C(=O)c2c1)c1ccc(Cl)cc1 |r|
CC(C)CCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCc1ccccc1)C(=O)NCCc1ccc(Cl)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCc1ccccc1)C(=O)NCCc1ccc(Cl)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCc1ccc(Cl)cc1)C(=O)NCCc1ccc(Cl)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccccc1)C(=O)NCCc1ccc(Cl)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccccc1)C(=O)NCCc1ccc(Br)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccccc1)C(=O)NCCCc1ccc(Br)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCc1ccc(Br)cc1)C(=O)NCCCc1ccccc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(C)cc1)C(=O)NCCc1ccc(Br)cc1
CC(C)CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(cc1)[N+]([O-])=O)C(=O)NCCc1ccc(Br)cc1
COc1ccc(CCCNC(=O)N(CCC(N)=O)CC(CCC(O)=O)N(CC(CCCCN)N(CC(CCC(O)=O)NC(N)=O)C(=O)NCCCC(C)C)C(=O)NCCc2ccc(Br)cc2)cc1
CC(C)CCCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(N)=O)C(=O)NCCCc1ccccc1
COc1ccc(CCCNC(=O)N(CC(CCC(O)=O)NC(N)=O)C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc2ccc(Br)cc2)C(=O)NCCc2ccc(Br)cc2)cc1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(N)=O)C(=O)NCCCc1ccc(cc1)[N+]([O-])=O
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(N)=O)C(=O)NCCCc1ccc(Br)cc1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(N)=O)C(=O)NCCCC1CCCCC1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(=O)Nc1ccccc1)C(=O)NCCCC1CCCCC1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(=O)NCC=C)C(=O)NCCCC1CCCCC1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(=O)NCC1CCCCC1)C(=O)NCCCC1CCCCC1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(=O)[C@@H]1CCCN1)C(=O)NCCCC1CCCCC1 |r|
CC(C)CCC(=O)NC(CCC(O)=O)CN(C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)C(=O)NCCCC1CCCCC1
NCCCCC(CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(Br)cc1)N(CC(CCC(O)=O)NC(=O)CCC1CCCCC1)C(=O)NCCCC1CCCCC1
CC(C)CCC(=O)NC(CCC(O)=O)CN(C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(F)cc1)C(=O)NCCc1ccc(Br)cc1)C(=O)NCCCC1CCCCC1
CC(C)CCC(=O)NC(CCC(O)=O)CN(C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(Br)cc1)C(=O)NCCc1ccc(C)cc1)C(=O)NCCCC1CCCCC1
CC(C)CCC(=O)NC(CCC(O)=O)CN(C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(F)cc1)C(=O)NCCc1ccc(C)cc1)C(=O)NCCCC1CCCCC1
CC(C)CCC(=O)NC(CCC(O)=O)CN(C(CCCCN)CN(C(CCC(O)=O)CN(CCC(N)=O)C(=O)NCCCCc1ccc(F)cc1)C(=O)NCCc1ccc(C)cc1)C(=O)NCCCC1CCCCC1
CC(C)CCC(=O)N[C@@H](CCCC(O)=O)CN([C@@H](CCCCN)CN([C@@H](CCCC(O)=O)CN(CCC(N)=O)C(=O)NCCCc1ccc(F)cc1)C(=O)NCCc1ccc(Br)cc1)C(=O)NCCCC1CCCCC1 |r|
NCCCC[C@@H](CN([C@@H](CCCCN)CN([C@@H](CCCCN)CN(CCC(N)=O)C(=O)NCCCc1ccc(F)cc1)C(=O)NCCc1ccc(Br)cc1)C(=O)NCCCC1CCCCC1)NC(N)=O |r|
CC(C)CCC(=O)NC(CCC(O)=O)CN(CCCCCC1CCCCC1)C(CCCCN)CN(CCCCc1ccc(Br)cc1)C(CCC(O)=O)CN(CCCCCc1ccc(F)cc1)CCC(N)=O
CC(NC(=O)CSc1nc(O)c(NC(C)=O)c(=O)[nH]1)c1ccccc1
O=C(CSc1nnc(-c2cccnc2)n1C1CCCCC1)NC1CCCCC1
C=CS(=O)(=O)c1ccc(Oc2ccc(cc2)S(=O)(=O)C=C)cc1
O=c1[nH]c2cc3OCOc3cc2cc1CN(Cc1nnnn1CC1CCCO1)C1CCCC1
CCN(CC)C(=O)CN1CCN(CC1)c1ncccn1
COc1ccccc1N1CCN(CC1)C(c1nnnn1C(C)C)c1ccc(C)cc1
[H]C12CC3([H])CC([H])(C1)CC(C2)(C3)C(=O)Nc1cnc(NC(=O)C2CC2)cc1C |TLB:8:1:12:6.9.5,8:6:12:1.11.2,THB:5:6:11:3.12.2|
COCc1cc(=O)[nH]c(Nc2nc3ccc(C)cc3o2)n1
Cc1noc(C)c1COc1ccc(cc1)C(=O)NCc1ccccn1
Cc1cc(C(=O)CSc2nnc(Nc3ccccc3)s2)c(C)n1CC1CCCO1
COc1ccc(CCNC(=O)COC(=O)c2cnc(C)cn2)cc1OC
FC(F)Oc1ccc(cc1)C(=O)COC(=O)C1CCCC1
COc1ccc(cc1)C1C(CCC(=O)N1c1cc(OC)c(OC)c(OC)c1)C(=O)N1CCCCC1
COc1ccc2[nH]c(C(O)=O)c(CCNC(C)=O)c2c1
CC1(C)CC(=O)C2C(c3cccs3)c3c(N=C2C1)nc(SCCN1CCOCC1)[nH]c3=O |c:16|
Nc1nc2CCCCCCc2c(-c2cccc(O)c2)c1C#N
COc1ccc(C)cc1S(=O)(=O)N(C)CC(=O)NC1CCCCC1
CCOC(=O)N1CCN(CC1)C(=O)C1CCCN(C1)S(=O)(=O)c1cc(C)ccc1OC
CN(C)c1oc(nc1C#N)-c1ccccc1Cl
OC(=O)c1ccc2c(c1)N(Cc1ccccc1F)C(=O)c1ccccc1S2=O
Clc1ccc(cc1)-c1nnc(NC(=O)c2ccccc2Br)o1
CC(C)c1nc(SCC(=O)Nc2cc(C)on2)c2c(n1)n(C)c(=O)n(C)c2=O
CC(=O)c1ccc(OCC(O)Cn2nnc3ccccc23)cc1
CN(C)C(=S)SSC(=S)N(C)C
ClC1=C(N2CCCCC2)C(=O)C(Cl)=C(c2cnc(s2)N2CCCCC2)C1=O |c:1,t:13|
COc1ccc(cc1)-c1nc(C)c(C(C)=O)n1O
Cn1c2nc(Br)n(CCCc3ccccc3)c2c(=O)[nH]c1=O
CC(C)c1ccc2NC(=O)C3(NN=C(S3)c3ccccc3)c2c1 |c:12|
CC1CCN(CC1)C(=O)n1cnc2cc(C)c(C)cc12
COc1ccc(NC(=O)C(Cl)=C(Cl)S(=O)Cc2ccc(C)cc2)cn1 |w:11.11|
CN(C)C(=S)SC(NC(C)=O)C(Cl)(Cl)Cl
Cc1cc(C)c(c(OC(=O)c2cc(F)c(F)cc2Cl)n1)S(=O)(=O)c1ccccc1
CCn1c2ccccc2c(=O)n(CC(=O)Nc2cc(OC)c(OC)c(OC)c2)c1=O
CCCN(CCC)CCNc1c(NC2CCN(CC2)C(=O)OCC)c(=O)c1=O
COc1ccc2[nH]c3c(ncnc3c2c1)N1CC(C)OC(C)C1
COC(=O)CSC1=C(C#N)C(=O)NC(S1)c1ccccc1 |c:6|
CC(=C)c1sc(nc1O)N1CCN(CC1)c1cccc(c1)C(F)(F)F
CCOC(=O)C1=C(O\C(S1)=C(\C#N)C(F)(F)F)c1ccccc1 |t:5|
CCN1CCN(CC1)C(=O)CCc1nc2ccccc2c(=O)[nH]1
CCN(CC(=O)Nc1ccc(cc1)N1CCOCC1)Cc1nc2ccccc2c(=O)[nH]1
O=C(CN1CCN(CC1)c1ncccn1)NCc1ccccc1
Brc1ccc(s1)C(=O)Nc1nc(cs1)-c1ccccn1
[O-][N+](=O)c1cc(ccc1Cl)C(=O)c1ccccc1C(=O)OCC(=O)NC1CCCCCC1
CN(CC(=O)OCC(=O)N1CCc2ccccc12)S(=O)(=O)c1ccc(NC(C)=O)cc1
COc1cccc(OC)c1C(=O)NNC(=O)c1cccc(COc2ccc3CCCc3c2)c1
Clc1ccc(C=NNC(=O)c2cccs2)s1 |w:6.6|
CCSc1nc2ccccc2n1C(=O)\C=C/c1ccc(OC)c(OC)c1
Cc1ccsc1C1Nc2ccc3ncccc3c2C2=C1C(=O)CCC2 |c:21|
CN(C)c1cc(nc(n1)-c1ccccn1)C(F)(F)F
[O-][N+](=O)c1cc(ccc1-n1cccn1)C(=O)Nc1ccc(Cl)cc1
COc1cc(\C=C\C(=O)n2c(SCC=C)nc3ccccc23)cc(OC)c1OC
CC(C)CC(=O)C=Cn1c2ccccc2oc1=S |w:6.5|
CCOC(=O)\C=C\C(=O)Nc1ccccc1-c1ccccc1NC(=O)\C=C\C(=O)OCC
CCOC(=O)C1CCN(CC1)C(=S)Nc1cc(C)ccc1C
CCSc1nc2ccccc2n1C(=O)\C=C\c1ccc(OC)c(OC)c1
CN(C(=O)c1cccc(COc2ccc(Cl)cc2Cl)c1)c1ccccc1
[O-][N+](=O)c1ccccc1S(=O)(=O)c1ccccc1C(=O)Nc1ccc(F)cc1
Clc1cccc(c1)-c1ccc(\C=C2/SC(=N)N(C2=O)c2nccs2)o1
Cc1ccc(cc1)C(=O)NN1C(=S)S\C(=C/c2cccn2C)C1=O
CCN(CC)c1ccc(\C=C2/C(=O)c3ccc(cc3C2=O)C(O)=O)cc1
Cc1nnc(NC(=O)C=Cc2ccccc2)[nH]1 |w:9.9|
Cc1ccc(cc1)-c1nc2ccccc2c(=O)n1-c1cccnc1
CC(=O)C=Cn1c2ccccc2oc1=S |w:4.4|
CCN(CC)c1ccc(\C=C2\C(=O)c3ccc(cc3C2=O)C(O)=O)cc1
CCc1c(C)c(C#N)c2nc3ccccc3n2c1Cl
COc1ccc(cc1OC)-c1cc(nc(SCC(=O)NCc2cnn(C)c2C)n1)C(F)(F)F
Cc1nn(CCCC(=O)NCc2ccccc2)c(C)c1[N+]([O-])=O
COc1cccc(C=NNC(=O)c2[nH]c(C)c(C(=O)NN=Cc3cccc(OC)c3)c2C)c1 |w:20.19,8.8|
CCCN(CCC)C(=S)Nc1cc(ccc1C(=O)OC)C(=O)OC
Clc1cccc(c1)C1CC(=O)C(=CNC2CCCC2)C(=O)C1 |(10.37,5.32,;8.83,5.32,;8.06,6.65,;6.52,6.65,;5.75,5.32,;6.52,3.98,;8.06,3.98,;5.75,2.65,;7.08,1.88,;7.08,.34,;8.41,-.43,;5.75,-.43,;5.75,-1.97,;4.41,-2.74,;4.41,-4.28,;3.17,-5.19,;3.64,-6.65,;5.18,-6.65,;5.66,-5.19,;4.41,.34,;3.08,-.43,;4.41,1.88,)|
[#6]-[#6]-[#7]-1-[#6](=S)-[#7](-[#6]-[#6])-[#6](=O)\[#6](=[#6]\[#6]=[#6]\c2ccco2)-[#6]-1=O
COCCn1c2ccc(cc2s\c1=N\C(=O)c1ccc(cc1)S(=O)(=O)N1CCCc2ccccc12)S(C)(=O)=O
NC(=O)c1c(NC(=O)C2CCCO2)sc2CCCCc12
[#6]-c1cc(\[#6]=[#6]-2\[#6](=O)-[#6]C([#6])([#6])[#6]-[#6]-2=O)c(-[#6])n1-c1ccc(-[#6])cc1
COc1ccc(cc1)-c1nsc(SCC(=O)Nc2ccc3OCOc3c2)n1
CC(C)Oc1ccc(cc1)C(=O)NC(=S)N1CCOCC1
[H]C12CC3([H])CC(O)(C1)CC(C2)(C3)c1ccc(NC(=O)\C=C\c2ccc(OC)c(OC)c2)cc1 |TLB:7:6:12:1.11.2,8:6:12:1.11.2,8:1:12:6.9.5,THB:2:1:9:3.12.5|
COc1ccc(C)cc1C1=Nc2ccccc2C1(C)C |t:10|
Cc1nn(c(C)c1Br)-c1nnc(NCc2ccccc2)nn1
Cc1ccccc1Nc1nnc(SCC2CCCCO2)s1
[H]C12CC3([H])CC([H])(C1)CC(C2)(C3)C(C)NC(=O)Cn1ncc(Cl)c(Cl)c1=O |TLB:8:6:12:1.11.2,8:1:12:6.9.5,THB:5:6:11:3.12.2|
CCCNC(=O)COC(=O)c1cccc(c1)S(=O)(=O)N(CC=C)c1cccc(c1)C(F)(F)F
COc1ccc(C)cc1NC(=O)C(OC(=O)CNC(=O)c1cc(C)cc(C)c1)c1ccccc1
Cc1ccc(C)c(NC(=O)C(Sc2nnc(o2)-c2cccs2)c2ccccc2)c1
Cc1cccc(Nc2nnc(SCC3CCCCO3)s2)c1C
Cc1cccc(Nc2nnc(SCC3CCCCO3)s2)c1
COCCNC(=O)C(=C\c1cccc(\C=C(/C#N)C(=O)NCCOC)c1)\C#N
COc1ccccc1OCC(=O)Nc1cc(ccc1N1CCCCC1)S(=O)(=O)N1CCCCC1
Clc1cnn(CC(=O)NCC2CCCCC2)c(=O)c1Cl
Clc1ccccc1C=NNC1=Nc2cccc3cccc1c23 |w:8.9,t:11|
Cc1n(nc2c(SCCN3CCOCC3)nnc(C)c12)-c1ccccc1F
COc1ccccc1-c1cc(SC)c(C#N)c(=O)o1
CC(C)c1ccc(OCc2cccc(c2)C(=O)NN=Cc2cccnc2)cc1 |w:18.18|
Cc1ccc2c(C=CC(C)(C)S2=O)c1 |c:6|
COc1ccc(cc1)C(=O)NCCSC1CCCCC1
O=C1NC(=Cc2ccc(o2)N2CCOCC2)C(=O)N1c1ccccc1 |w:4.4|
Cc1nc(c(SCc2ccc(F)cc2)[nH]1)[N+]([O-])=O
[O-][N+](=O)c1cc(ccc1Cl)C(=O)NCCC1=CCCCC1 |t:16|
COc1ccc(Nc2nc(cs2)C(=O)N2CCc3ccccc3C2)cc1
OCc1ccc(CN2CCC(CC2)N2CCC(CC2)C(=O)NCCc2ccccc2)o1
CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCN=C1SCc1cccnc1 |c:17|
Cc1cc(OC(=O)c2ccccc2)c([N+]([O-])=O)c(=O)[nH]1
Cc1ccc(NC(=O)CCC2CC(C)(C)OC2=O)cc1
COc1ccc(OC)c(CNn2c(nc3ccccc3c2=O)-c2ccccc2F)c1
[O-][N+](=O)c1ccc2c(NC3(CCCCC3)[N+]2=O)c1[N-]CCc1ccccc1
CCOc1ccc(NC(=S)NCCCN2CCOCC2)cc1
CCCOC(=O)c1ccc(O)c(OC)c1
CCOC(=O)COc1ccc(cc1)C1CC(C)=NN1c1ccccc1 |c:17|
COCCNc1nc2nonc2nc1N(C)Cc1cccc2cnccc12
CCOC(=O)Cn1nnnc1C
OC(=O)c1cccc(c1)-n1[nH]c(=C)c(=CC=Cc2ccccc2)c1=O |w:14.15|
CC(C)CC(=O)N1CCN(CC1)S(=O)(=O)c1ccc(C)cc1
Fc1ccc(CCN2C(=O)NC(=O)\C(=C\C=C\c3ccccc3)C2=O)cc1
Cc1cc2cc(C)c(SCC(=O)NCc3ccco3)nc2cc1C
COc1cc2CCN(Cc2cc1OC)C(=O)c1ccco1
Clc1ccc(cn1)C(=O)N(C(C(=O)NC1CCCCC1)c1cccnc1)C1CCCCC1
CCOC(=O)c1sc(=S)n(c1N(C(C)=O)C(C)=O)-c1ccccc1
COc1ccc(cc1)C1C(C(=O)N2CCN(C)CC2)c2cc(OC)c(OC)cc2C(=O)N1C
COc1ccc(cc1OC)-c1cc(nc(n1)S(=O)(=O)CCCC(=O)Nc1cccnc1Cl)C(F)(F)F
COc1ccccc1-c1cc(nc(n1)S(=O)(=O)CCCC(=O)Nc1cccnc1Cl)C(F)(F)F
CC(CCc1ccccc1)NC(=O)C1=C(C)C(=O)OC11CCC(C)CC1 |c:14|
Cc1cc(C(=O)Nc2cccc3ccccc23)n(n1)-c1ccccc1
[O-][N+](=O)c1cccc(\C=C\C(=O)n2cnc3ccccc23)c1
O=C(CSc1ccc(nn1)-c1ccco1)NC1CCCC1
COC(=O)c1c(\C=C\N(C)C)onc1-c1ccccc1Cl
CCCNc1cc(COC)nc(n1)-c1ccccc1
CN(C)\C=C\c1snc(SCc2csc(C)n2)c1C#N
Cn1cc\c(=N/C=C(C#N)C#N)c2ccccc12 |(7.08,5,;7.08,3.47,;5.75,2.7,;5.75,1.16,;7.08,.39,;7.08,-1.16,;5.75,-1.93,;5.75,-3.47,;4.41,-4.24,;3.08,-5,;7.08,-4.24,;8.41,-5,;8.41,1.16,;9.79,.33,;11.19,1.12,;11.19,2.73,;9.79,3.52,;8.41,2.7,)|
COc1ccc(CS(=O)C(Cl)=C(Cl)C(=O)Nc2ccc(OC)nc2)cc1 |w:9.9|
COc1ccc(cc1)S(=O)(=O)NN(C)c1ncc(cc1Cl)C(F)(F)F
COc1ccc(NC(=O)C(Cl)=C(Cl)S(=O)Cc2ccc(Cl)cc2)cn1 |w:11.11|
CSc1nsc(CC=Nc2ccc(F)cc2)c1C#N |w:8.8|
CCOC(=O)C1C(N(C)OC1(O)C(F)(F)F)c1ccccc1
Clc1ccccc1Cn1c2ccccc2c(=O)n(-c2ccc(CC(=O)NCC3CCCO3)cc2)c1=O
O=C(Nc1ccncc1)Nc1ccncc1
COc1ccc(OCC(=O)N[N-][C+](C)CC(=O)Nc2cccc(c2)[N+]([O-])=O)cc1
CCOc1ccc(NC(=O)CN(C)S(=O)(=O)c2c[nH]cn2)cc1
O=C(Nc1ccc2C(=O)NC(=O)c2c1)C1COc2ccccc2O1
OC(c1cccs1)c1nnc(o1)-c1ccccc1
CCN1C\C(=C\c2ccc(OC)c(O)c2)C(=O)\C(C1)=C\c1ccc(OC)c(O)c1
[H][C@@]12O[C@]1(C)[C@@H](C)[C@@]1([H])[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@]11C(=O)C=CC(=O)[C@H](O)C(C)=C[C@@H](C)CC=C[C@@]21[H]
Nc1cccc2C(=O)N(C(=O)\C=C\c3cccc(Br)c3)C(=O)c12
[#6]-c1ccc(\[#6]=[#6]-2\[#6](Cl)=[#6](Cl)-[#6](Cl)=[#6]-2Cl)cc1 |c:12,t:8|
O=C(C=Cc1cccnc1)C=Cc1cccnc1
CN(C)c1n\c(=N\Cc2ccco2)ss1
CCOC(=O)N1CC(=Cc2ccccc2)C(=O)C(C1)=Cc1ccccc1
Cc1cccc2n(C)c3c4C(=O)C=CC(=O)c4ccc3c12 |c:12|
O=C1N=c2ccccc2=C1NNC(=S)N1CCOCC1 |c:9,t:2|
C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](OC(C)=O)[C@@]2(C)[C@H]1C=CC2=O |c:20|
C[C@@H]1C[C@@H]2OC(=O)C(=C)[C@H]2C[C@@]2(C)[C@H]1C=CC2=O |c:16|
C[C@@H]1C[C@H]2OC(=O)C(=C)[C@H]2[C@H](O)[C@@]2(C)[C@H]1C=CC2=O |c:17|
[H][C@@]12C[C@@H](C)[C@]3([H])C4OC4C(=O)[C@@]3(C)[C@@H](O)[C@]1([H])C(=C)C(=O)O2
[H][C@@]12N(C)c3ccc(OC)cc3[C@@]11C[C@H](N=C1NC(C(=O)OC)=C2C(=O)OC)C(=O)OC |c:17,25|
COc1cc(NC(=O)c2cnc(N)s2)cc(c1)C(=O)Nc1cccc(c1)C(F)(F)F
Cc1cc(C)nc(S\C=C\C(=O)c2ccccc2F)n1
Cc1cc(C)nc(S\C=C\C(=O)c2ccccc2)n1
Cc1cc(C)nc(S\C=C\C(=O)c2ccc(F)cc2)n1
COc1cc(\C=C2/COC\C(=C/c3cc(OC)c(OC)c(OC)c3)C2=O)cc(OC)c1OC
Clc1cc(Cl)cc(c1)N1CC(=O)N(CC1=O)N=Cc1cccnc1 |w:16.17|
O=C(Nc1ccc(cc1)-c1csnn1)C1CC1
FC(F)(F)c1ccc(NC(=O)CSC2=NNC(S2)c2ccccn2)cc1 |t:13|
C(SC1=NNC(S1)c1ccccn1)c1ccccc1 |t:2|
CN1C(CC2Cn3c(nc4cc5ccccc5cc34)C12)C(=O)NCc1cccc(Br)c1
CC(C)n1cnc2c(nc(nc12)N(CCN(C)C)Cc1ccccc1)N(C)c1ccccc1
O=C1CCN(Cc2ccccc2)S(=O)(=O)c2ccccc12
COC(=O)C(C(C)C)N1CCC(=C)c2ccccc2S1(=O)=O
Cc1ccc2n(C)c3c4C(=O)C=CC(=O)c4ccc3c2c1 |c:11|
CCCC(C)(O)C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O |(12,-8.47,;10.67,-7.7,;10.67,-6.16,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,;-1.33,-.77,;-2.67,,;-4,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,)|
CCC(=O)NC(c1cccs1)c1cc([N+]([O-])=O)c2cccnc2c1O
Cc1ccc(C)c(c1)C(Nc1cccnc1)c1cc(Cl)c2cccnc2c1O
Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1ccccc1Cl
Cc1cccc(NC(c2ccc(cc2)C(F)(F)F)c2ccc3cccnc3c2O)n1
Oc1c(ccc2cccnc12)C(Nc1cccnc1)c1ccc(cc1)C(F)(F)F
Cc1cc(Cl)cnc1NC(c1ccc2cccnc2c1O)c1c(F)c(F)c(OCC(F)(F)F)c(F)c1F
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,31.35,wD:17.19,5.4,7.32,35.39,(4.33,-1.78,;3,-1.01,;3,.53,;4.33,-.24,;1.67,-1.78,;.33,-1.01,;.33,.53,;-1.13,1.01,;-2.04,-.24,;-3.52,.16,;-4.61,-.93,;-6.1,-.53,;-6.5,.96,;-5.41,2.04,;-5.81,3.53,;-3.92,1.65,;-4.32,3.13,;-1.13,-1.49,;-.23,-2.73,;1.31,-2.73,;-1.13,-3.98,;-2.6,-3.5,;-3.93,-4.27,;-5.26,-3.5,;-6.6,-4.27,;-5.26,-1.96,;-6.6,-1.19,;-3.93,-1.19,;-2.6,-1.96,;-1.53,2.49,;-3.02,2.89,;-.44,3.58,;1.05,3.18,;2.13,4.27,;3.62,3.87,;4.02,2.39,;5.51,1.99,;2.93,1.3,;1.44,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,30.34,wD:17.19,5.4,7.31,34.38,(4.33,-1.78,;3,-1.01,;3,.53,;4.33,-.24,;1.67,-1.78,;.33,-1.01,;.33,.53,;-1.13,1.01,;-2.04,-.24,;-3.52,.16,;-4.61,-.93,;-6.1,-.53,;-6.5,.96,;-5.41,2.04,;-5.81,3.53,;-3.92,1.65,;-4.32,3.13,;-1.13,-1.49,;-.23,-2.73,;1.31,-2.73,;-1.13,-3.98,;-2.6,-3.5,;-3.93,-4.27,;-5.26,-3.5,;-6.6,-4.27,;-5.26,-1.96,;-3.93,-1.19,;-2.6,-1.96,;-1.53,2.49,;-3.02,2.89,;-.44,3.58,;1.05,3.18,;2.13,4.27,;3.62,3.87,;4.02,2.39,;5.51,1.99,;2.93,1.3,;1.44,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC1CC[C@@H](CC1)OC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C |r,wU:8.8,31.35,41.46,wD:17.19,5.4,7.32,35.42,(4.33,-1.78,;3,-1.01,;3,.53,;4.33,-.24,;1.67,-1.78,;.33,-1.01,;.33,.53,;-1.13,1.01,;-2.04,-.24,;-3.52,.16,;-4.61,-.93,;-6.1,-.53,;-6.5,.96,;-5.41,2.04,;-5.81,3.53,;-3.92,1.65,;-4.32,3.13,;-1.13,-1.49,;-.23,-2.73,;1.31,-2.73,;-1.13,-3.98,;-2.6,-3.5,;-3.93,-4.27,;-5.26,-3.5,;-6.6,-4.27,;-5.26,-1.96,;-6.6,-1.19,;-3.93,-1.19,;-2.6,-1.96,;-1.53,2.49,;-3.02,2.89,;-.44,3.58,;1.05,3.18,;2.13,4.27,;3.62,3.87,;4.02,2.39,;2.93,1.3,;1.44,1.7,;5.51,1.99,;6.6,3.08,;6.2,4.56,;8.09,2.68,;8.86,1.34,;10.34,.95,;10.34,-.59,;11.68,-1.36,;13.01,-.59,;13.01,.95,;11.68,1.72,;9.17,3.77,;8.78,5.25,;7.44,6.02,;9.86,6.34,;11.35,5.94,;12.84,5.55,;11.75,4.46,;12.44,7.03,)|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CC2CCCCC2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CC(C)(C)C)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CC(C)(C)C)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@@H](O)CO)c1cccc(Cl)c1F)C(=O)Nc1cc(F)c(F)cc21 |r|
O[C@H]1C[C@@H](OC2(N(Cc3ccc(cc3)C#N)C(=O)c3ccccc23)c2ccc(Cl)cc2)C=C1 |r,c:35|
O[C@H]1C[C@@H](OC2(N(Cc3ccc(Cl)cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)C=C1 |r,c:34|
CCCN1C(=O)c2ccccc2C1(O[C@@H]1C[C@H](O)C=C1)c1ccc(Cl)cc1 |r,c:20|
Cc1ccc(CN2C(=O)c3ccccc3C2(O[C@@H]2C[C@H](O)C=C2)c2ccc(Cl)cc2)cc1 |r,c:23|
O[C@H]1C[C@@H](OC2(N(Cc3ccccc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)C=C1 |r,c:33|
OCCCCOC1(N(CCc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:6.5|
C[C@@H](N1C(=O)c2ccccc2C1(OCCCCO)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r,w:11.13|
OCCCCOC1(N(Cc2ccc(cc2)C#N)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:6.5|
O[C@H]1C[C@@H](OC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)C=C1 |r,c:36|
OC\C=C/COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:6.5|
OCC=CCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:6.5,2.1|
O[C@H]1CCC[C@H](CCC1)OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r,w:10.10|
CC(C)(CO)COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:7.6|
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |w:5.4|
OCC#CCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:6.5|
OC[C@H]1CC[C@H](COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |r,w:8.7,wU:5.5,wD:2.1,(-5.52,8.06,;-4.18,7.29,;-4.18,5.75,;-5.52,4.98,;-5.52,3.44,;-4.18,2.67,;-4.18,1.13,;-2.85,.36,;-2.08,-.97,;-1.17,-2.22,;.37,-2.22,;1.46,-3.31,;1.06,-4.79,;2.15,-5.88,;3.63,-5.49,;4.03,-4,;2.94,-2.91,;4.72,-6.57,;4.32,-8.06,;6.21,-6.18,;-2.08,-3.46,;-1.31,-4.8,;-3.54,-2.99,;-4.88,-3.76,;-6.21,-2.99,;-6.21,-1.45,;-4.88,-.68,;-3.54,-1.45,;-.99,.12,;.5,-.28,;1.59,.81,;1.19,2.29,;2.28,3.38,;-.3,2.69,;-1.39,1.6,;-2.85,3.44,;-2.85,4.98,)|
OC[C@H]1CCCC[C@H]1COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r,w:10.10|
OC1CC[C@@H](CC1)OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r,w:8.8,1.0,wU:4.7,(-4.44,7.19,;-4.04,5.7,;-5.13,4.61,;-4.73,3.12,;-3.25,2.72,;-2.16,3.81,;-2.56,5.3,;-2.85,1.24,;-2.08,-.1,;-1.17,-1.34,;.37,-1.34,;1.46,-2.43,;1.06,-3.92,;2.15,-5.01,;3.63,-4.61,;4.03,-3.12,;2.94,-2.03,;4.72,-5.7,;4.32,-7.19,;6.21,-5.3,;-2.08,-2.59,;-1.31,-3.92,;-3.54,-2.11,;-4.88,-2.88,;-6.21,-2.11,;-6.21,-.57,;-4.88,.2,;-3.54,-.57,;-.99,.99,;.5,.59,;1.59,1.68,;1.19,3.17,;2.28,4.26,;-.3,3.57,;-1.39,2.48,)|
O[C@H]1CC[C@H](OC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)C=C1 |r,w:6.5,c:37|
C[C@H](N1C(=O)c2ccccc2C1(OCCCCO)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r,w:11.13|
OCc1ccc(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)cc1 |w:8.7|
OCc1cccc(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)c1 |w:9.8|
NCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:5.4|
OCCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Br)cc1 |w:6.5|
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Br)cc2)CC1 |w:5.4|
OCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Br)cc1 |w:5.4|
Cc1cccc2C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)C(O)(c12)c1ccc(Cl)cc1
Cc1cccc2c1C(=O)N(Cc1ccc(cc1)[N+]([O-])=O)C2(O)c1ccc(Cl)cc1
Cc1ccc2C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)C(O)(c2c1)c1ccc(Cl)cc1
CC(C)(C)c1ccc2C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)C(O)(c2c1)c1ccc(Cl)cc1
CC(C)(C)c1ccc2c(c1)C(=O)N(Cc1ccc(cc1)[N+]([O-])=O)C2(O)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2cccc(Cl)c12)c1ccc(Cl)cc1
CC(C)(C)c1ccc2c(c1)C(=O)N(Cc1ccc(cc1)[N+]([O-])=O)C2(OCC1(CO)CC1)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccc(F)cc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2cc(F)ccc12)c1ccc(Cl)cc1
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3cc(Cl)c(Cl)cc23)c2ccc(Cl)cc2)CC1
OC1(N(Cc2ccc(cc2)C#N)C(=O)c2cccc(Cl)c12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)C#N)C(=O)c2c1cccc2Cl)c1ccc(Cl)cc1
OC1(N(Cc2ccc(Br)cc2)C(=O)c2cccc(Cl)c12)c1ccc(Cl)cc1
OCC1(COC2(N(Cc3ccc(cc3)C#N)C(=O)c3cccc(Cl)c23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(Br)cc3)C(=O)c3cccc(Cl)c23)c2ccc(Cl)cc2)CC1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)C2=C1CCCC2)c1ccc(Cl)cc1 |c:16|
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccc(F)cc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3cc(F)ccc23)c2ccc(Cl)cc2)CC1
CC(C)(C)c1ccc2C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)C(OCC3(CO)CC3)(c2c1)c1ccc(Cl)cc1
Cc1ccc2C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)C(OCC3(CO)CC3)(c2c1)c1ccc(Cl)cc1
Cc1cccc2C(=O)N(Cc3ccc(cc3)[N+]([O-])=O)C(OCC3(CO)CC3)(c12)c1ccc(Cl)cc1
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3cccc(Cl)c23)c2ccc(Cl)cc2)CC1
Cc1ccc2c(c1)C(=O)N(Cc1ccc(cc1)[N+]([O-])=O)C2(O)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2cc(Br)ccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccc(Br)cc12)c1ccc(Cl)cc1
OCC1(COC2(N(Cc3ccc(cc3)C#N)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(Cl)cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(Br)cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
CC(N1C(=O)c2ccccc2C1(OCC1(CO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1
C[C@H](N1C(=O)c2ccccc2C1(OCC1(CO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r|
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccc(Br)cc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3cc(Br)ccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccccn3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2cccc(Cl)c12)c1ccc(Cl)cc1 |w:1.0|
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2c1cccc2Cl)c1ccc(Cl)cc1 |w:1.0|
CC(=O)c1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
OCC1(COC2(N(Cc3ccc(I)cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |w:5.4|
CC(=O)c1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1
OC1(N(Cc2cccc3ccccc23)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:1.0|
OCC1(COC2(N(Cc3cccc4ccccc34)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |w:5.4|
OCC1(COC2(N(Cc3cccc(Br)c3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |w:5.4|
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccccc1 |w:1.0|
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccccc2)CC1 |w:5.4|
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(F)cc1 |w:1.0|
OC(=O)CCC(=O)OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3cccc(Cl)c23)c2ccc(Cl)cc2)CC1 |w:12.11|
OC(=O)CCC(=O)OCC1(COC2(N(Cc3ccc(cc3)C#N)C(=O)c3cccc(Cl)c23)c2ccc(Cl)cc2)CC1 |w:12.11|
OC(=O)CCC(=O)OCC1(COC2(N(Cc3ccc(Br)cc3)C(=O)c3cccc(Cl)c23)c2ccc(Cl)cc2)CC1 |w:12.11|
Cc1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1 |w:15.17|
COc1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1 |w:16.18|
OCC(=C)COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |w:6.5|
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(F)cc2)CC1 |w:5.4|
OC1(N(Cc2ccc(cc2)N=O)C(=O)c2ccc(F)c(Cl)c12)c1ccc(Cl)cc1 |w:1.0|
CC1(C)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:14.16,5.5,wD:4.28,31.35,(2.21,-1.78,;.88,-1.01,;2.36,-.61,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:17.30,18.21,wD:10.10,1.0,(6.05,1.99,;4.57,2.39,;4.17,3.87,;2.68,4.27,;1.59,3.18,;1.99,1.7,;3.48,1.3,;.1,3.58,;-.99,2.49,;-2.47,2.89,;-.59,1.01,;.88,.53,;.88,-1.01,;2.21,-.24,;3.75,-.24,;3.75,-1.78,;2.21,-1.78,;-.59,-1.49,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:19.32,20.23,wD:10.10,1.0,(6.05,1.99,;4.57,2.39,;4.17,3.87,;2.68,4.27,;1.59,3.18,;1.99,1.7,;3.48,1.3,;.1,3.58,;-.99,2.49,;-2.47,2.89,;-.59,1.01,;.88,.53,;.88,-1.01,;2.37,-.7,;3.47,.45,;4.8,-.32,;4.64,-1.47,;3.31,-.7,;2.21,-1.78,;-.59,-1.49,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:13.25,14.16,wD:10.10,1.0,(6.05,1.99,;4.57,2.39,;4.17,3.87,;2.68,4.27,;1.59,3.18,;1.99,1.7,;3.48,1.3,;.1,3.58,;-.99,2.49,;-2.47,2.89,;-.59,1.01,;.88,.53,;.88,-1.01,;-.59,-1.49,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,)|
CCC1(CC)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCC(F)(F)CC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCC(F)(F)CC2)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCC(F)(F)CC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.33,21.24,wD:10.10,1.0,(6.44,3.26,;4.9,3.26,;4.13,4.59,;2.59,4.59,;1.82,3.26,;2.59,1.93,;4.13,1.93,;.28,3.26,;-.81,2.17,;-1.58,3.51,;-.41,.68,;1.06,.21,;1.06,-1.33,;2.39,-.56,;3.48,-1.71,;4.98,-2.02,;6.47,-2.42,;5.38,-.53,;3.65,-2.79,;2.55,-1.71,;-.41,-1.81,;-1.31,-.56,;-2.4,.53,;-2,2.01,;-3.09,3.1,;-4.58,2.7,;-4.98,1.22,;-6.47,.82,;-3.89,.13,;-4.29,-1.36,;.5,-3.05,;2.04,-3.05,;-.41,-4.3,;-1.87,-3.82,;-3.21,-4.59,;-4.54,-3.82,;-5.87,-4.59,;-4.54,-2.28,;-3.21,-1.51,;-1.87,-2.28,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCOCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:19.22,wD:18.31,10.10,1.0,(6.78,3.13,;5.24,3.13,;4.47,4.46,;2.93,4.46,;2.16,3.13,;2.93,1.79,;4.47,1.79,;.62,3.13,;-.72,2.36,;-2.05,3.13,;-.72,.82,;.75,.34,;.75,-1.2,;2.29,-1.2,;3.62,-1.96,;4.71,-.87,;3.17,-.87,;1.84,-.11,;-.72,-1.67,;-1.62,-.43,;-2.71,.66,;-2.31,2.15,;-3.4,3.24,;-4.89,2.84,;-5.29,1.35,;-6.78,.95,;-4.2,.26,;-4.6,-1.23,;.19,-2.92,;1.73,-2.92,;-.72,-4.17,;-2.18,-3.69,;-3.52,-4.46,;-4.85,-3.69,;-6.18,-4.46,;-4.85,-2.15,;-3.52,-1.38,;-2.18,-2.15,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCOCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.31,19.22,wD:10.10,1.0,(6.78,3.13,;5.24,3.13,;4.47,4.46,;2.93,4.46,;2.16,3.13,;2.93,1.79,;4.47,1.79,;.62,3.13,;-.72,2.36,;-2.05,3.13,;-.72,.82,;.75,.34,;.75,-1.2,;2.29,-1.2,;3.62,-1.96,;4.71,-.87,;3.17,-.87,;1.84,-.11,;-.72,-1.67,;-1.62,-.43,;-2.71,.66,;-2.31,2.15,;-3.4,3.24,;-4.89,2.84,;-5.29,1.35,;-6.78,.95,;-4.2,.26,;-4.6,-1.23,;.19,-2.92,;1.73,-2.92,;-.72,-4.17,;-2.18,-3.69,;-3.52,-4.46,;-4.85,-3.69,;-6.18,-4.46,;-4.85,-2.15,;-3.52,-1.38,;-2.18,-2.15,)|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCOCC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CNC(=O)[C@@H]1NC2(CCNCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CNC(=O)[C@@H]1NC2(CCNCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCCCC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CNC(=O)[C@@H]1NC2(CCN(C)CC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CNC(=O)[C@@H]1NC2(CCN(C)CC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CNC(=O)[C@@H]1NC2(CCN(CC2)C(C)=O)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CNC(=O)[C@@H]1NC2(CCN(CC2)C(C)=O)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CS(=O)(=O)CCNC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CNC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CS(=O)(=O)CCN1CCC(CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)CCCNC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)[C@H]1CCC(CNC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r,wU:19.31,20.22,wD:11.10,3.2,(7.29,3.25,;6.2,4.34,;6.6,5.83,;4.72,3.94,;3.63,5.03,;2.14,4.63,;1.74,3.14,;.25,2.75,;-.15,1.26,;-1.63,.86,;-2.72,1.95,;-1.23,-.63,;.23,-1.1,;.23,-2.64,;1.72,-3.02,;2.82,-4.1,;4.15,-3.33,;2.66,-3.02,;1.56,-1.87,;-1.26,-3.04,;-2.14,-1.87,;-3.23,-.78,;-2.83,.7,;-3.92,1.79,;-5.41,1.39,;-5.8,-.09,;-7.29,-.49,;-4.72,-1.18,;-5.11,-2.67,;-.35,-4.29,;1.19,-4.29,;-1.26,-5.53,;-2.72,-5.06,;-4.06,-5.83,;-5.39,-5.06,;-6.72,-5.83,;-5.39,-3.52,;-4.06,-2.75,;-2.72,-3.52,;2.83,2.06,;4.32,2.45,)|
OC(=O)c1ccc(CNC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
CS(=O)(=O)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
COc1cc(ccc1NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCCCC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCc1nnn[nH]1 |r|
C[C@@]1(O)CC(C1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:17.30,18.21,1.1,wD:9.9,1.0,(3.48,5.68,;2.39,4.59,;1.99,6.08,;1.05,3.82,;1.82,2.49,;3.16,3.26,;1.42,1,;-.06,.61,;-1.15,1.69,;.34,-.88,;1.8,-1.36,;1.8,-2.9,;3.29,-3.27,;4.39,-4.35,;5.72,-3.59,;4.23,-3.27,;3.13,-2.13,;.31,-3.3,;-.57,-2.13,;-1.66,-1.04,;-1.26,.45,;-2.35,1.54,;-3.84,1.14,;-4.24,-.35,;-5.72,-.75,;-3.15,-1.44,;-3.54,-2.93,;1.22,-4.54,;2.76,-4.54,;.31,-5.79,;-1.15,-5.31,;-2.49,-6.08,;-3.82,-5.31,;-5.15,-6.08,;-3.82,-3.77,;-2.49,-3,;-1.15,-3.77,)|
CNC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cc(Cl)ccc1OC(C)(C)C(O)=O)C(=O)Nc1cc(Cl)ccc21 |r|
CNC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cc(Cl)cnc1OC(C)(C)C(O)=O)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cn1 |r|
OC(=O)CN1CCC(CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CC(=O)N1CC(C1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)N1CC(C1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.33,21.24,3.2,wD:12.12,(4.51,6.37,;3.02,5.97,;1.93,7.06,;2.62,4.49,;3.71,3.4,;3.31,1.91,;1.82,1.51,;.73,2.6,;1.13,4.09,;1.42,.02,;-.06,-.37,;-1.15,.71,;.34,-1.86,;1.8,-2.34,;1.8,-3.88,;3.29,-4.25,;4.39,-5.34,;5.72,-4.57,;4.23,-4.25,;3.13,-3.11,;.31,-4.28,;-.57,-3.11,;-1.66,-2.02,;-1.26,-.53,;-2.35,.56,;-3.84,.16,;-4.24,-1.33,;-5.72,-1.73,;-3.15,-2.42,;-3.54,-3.91,;1.22,-5.52,;2.76,-5.52,;.31,-6.77,;-1.15,-6.29,;-2.49,-7.06,;-3.82,-6.29,;-5.15,-7.06,;-3.82,-4.75,;-2.49,-3.98,;-1.15,-4.75,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.31,19.22,1.0,wD:10.10,(3.02,6.52,;2.62,5.03,;3.71,3.94,;3.31,2.45,;1.82,2.06,;.73,3.14,;1.13,4.63,;1.42,.57,;-.06,.17,;-1.15,1.26,;.34,-1.32,;1.8,-1.79,;1.8,-3.33,;3.29,-3.71,;4.39,-4.79,;5.72,-4.02,;4.23,-3.71,;3.13,-2.56,;.31,-3.73,;-.57,-2.56,;-1.66,-1.47,;-1.26,.01,;-2.35,1.1,;-3.84,.7,;-4.24,-.78,;-5.72,-1.18,;-3.15,-1.87,;-3.54,-3.36,;1.22,-4.98,;2.76,-4.98,;.31,-6.22,;-1.15,-5.75,;-2.49,-6.52,;-3.82,-5.75,;-5.15,-6.52,;-3.82,-4.21,;-2.49,-3.44,;-1.15,-4.21,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cncc(Cl)c1)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.30,19.22,4.7,wD:10.10,1.0,(3.02,6.52,;2.62,5.03,;1.13,4.63,;.73,3.14,;1.82,2.06,;3.31,2.45,;3.71,3.94,;1.42,.57,;-.06,.17,;-1.15,1.26,;.34,-1.32,;1.8,-1.79,;1.8,-3.33,;3.29,-3.71,;4.39,-4.79,;5.72,-4.02,;4.23,-3.71,;3.13,-2.56,;.31,-3.73,;-.57,-2.56,;-1.66,-1.47,;-1.26,.01,;-2.35,1.1,;-3.84,.7,;-4.24,-.78,;-5.72,-1.18,;-3.15,-1.87,;1.22,-4.98,;2.76,-4.98,;.31,-6.22,;-1.15,-5.75,;-2.49,-6.52,;-3.82,-5.75,;-5.15,-6.52,;-3.82,-4.21,;-2.49,-3.44,;-1.15,-4.21,)|
OC(=O)c1cccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)c1 |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(F)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:17.19,8.8,5.4,wD:7.31,34.38,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:17.19,8.8,5.4,wD:7.32,35.39,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-6.05,-1.19,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:17.19,8.8,5.4,wD:7.32,35.39,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-6.05,-1.19,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:16.18,8.8,5.4,wD:7.30,33.37,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:16.18,8.8,5.4,wD:34.38,7.31,(4.22,-2.66,;3.13,-1.57,;3.53,-.08,;4.62,-1.17,;1.64,-1.97,;.56,-.88,;.56,.66,;-.91,1.14,;-1.81,-.11,;-3.3,.29,;-4.39,-.8,;-5.88,-.4,;-6.28,1.09,;-5.19,2.18,;-5.59,3.67,;-3.7,1.78,;-.91,-1.35,;-0,-2.6,;1.48,-3,;-.91,-3.84,;-2.37,-3.37,;-3.71,-4.14,;-5.04,-3.37,;-6.37,-4.14,;-5.04,-1.83,;-6.37,-1.06,;-3.71,-1.06,;-2.37,-1.83,;-.91,2.68,;-2.24,3.45,;.42,3.45,;1.91,3.05,;3,4.14,;4.49,3.74,;4.89,2.25,;6.37,1.85,;3.8,1.16,;2.31,1.56,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(F)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,31.34,33.38,wD:7.31,33.37,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,32.35,34.39,wD:7.32,34.38,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-5.68,-.82,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,32.35,34.39,wD:7.32,34.38,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-5.68,-.82,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:8.8,31.34,33.38,wD:17.19,5.4,7.31,33.37,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:16.18,8.8,5.4,30.33,32.37,wD:7.30,32.36,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:16.18,8.8,5.4,31.34,33.38,wD:7.31,33.37,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-5.68,-.82,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@@H]1N([C@H]([C@H](c2cccc(F)c2F)C11C(=O)Nc2cc(Cl)c(F)cc12)C(O)=O)N(C1CC(C)(O)C1)C(=O)C(F)(F)F |wU:5.4,8.8,wD:7.32,(4.34,.24,;2.82,.03,;1.29,-.19,;2.6,1.55,;3.03,-1.5,;1.81,-2.45,;.33,-2.02,;-.53,-3.29,;.41,-4.51,;-.01,-5.99,;-1.51,-6.36,;-1.94,-7.84,;-.87,-8.95,;.63,-8.58,;1.69,-9.69,;1.05,-7.1,;2.48,-7.68,;1.86,-3.98,;1.91,-5.52,;1.96,-7.06,;3.39,-5.95,;4.26,-4.68,;5.78,-4.47,;6.36,-3.04,;7.89,-2.83,;5.42,-1.82,;6,-.4,;3.89,-2.03,;3.31,-3.46,;-2.07,-3.34,;-2.88,-2.04,;-2.8,-4.7,;-.19,-.57,;.8,.61,;.67,2.14,;2.2,2.27,;2.43,3.8,;3.67,2.76,;2.34,.74,;-1.71,-.3,;-2.7,-1.48,;-2.23,1.15,;-.78,1.67,;-3.68,.63,;-2.76,2.6,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:8.8,31.34,33.38,wD:17.19,5.4,7.31,33.37,(4.84,-2.42,;3.75,-1.33,;4.15,.16,;5.24,-.93,;2.27,-1.73,;1.18,-.64,;1.18,.9,;-.29,1.38,;-1.19,.13,;-2.68,.53,;-3.77,-.56,;-5.26,-.16,;-5.66,1.33,;-4.57,2.41,;-4.97,3.9,;-3.08,2.02,;-3.08,3.56,;-.29,-1.12,;.62,-2.36,;2.11,-2.76,;-.29,-3.61,;-1.75,-3.13,;-3.09,-3.9,;-4.42,-3.13,;-5.75,-3.9,;-4.42,-1.59,;-3.09,-.82,;-1.75,-1.59,;-.29,2.92,;-1.62,3.69,;1.05,3.69,;2.38,2.92,;3.87,3.31,;4.27,1.83,;5.6,1.06,;5.75,2.23,;2.78,1.43,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,wD:17.19,5.4,34.38,7.31,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.38,3.19,;-.59,-1.49,;.32,-2.73,;1.81,-3.13,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(F)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,wD:17.19,5.4,34.38,7.31,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,wD:17.19,5.4,35.39,7.32,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-6.05,-1.19,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,wD:17.19,5.4,34.38,7.31,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,31.34,33.38,wD:7.31,33.37,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:17.19,8.8,5.4,wD:34.38,7.31,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@](C)(O)C1 |r,wU:8.8,31.34,33.37,wD:17.19,5.4,7.31,33.38,(4.84,-2.42,;3.75,-1.33,;4.15,.16,;5.24,-.93,;2.27,-1.73,;1.18,-.64,;1.18,.9,;-.29,1.38,;-1.19,.13,;-2.68,.53,;-3.77,-.56,;-5.26,-.16,;-5.66,1.33,;-4.57,2.41,;-4.97,3.9,;-3.08,2.02,;-3.08,3.56,;-.29,-1.12,;.62,-2.36,;2.11,-2.76,;-.29,-3.61,;-1.75,-3.13,;-3.09,-3.9,;-4.42,-3.13,;-5.75,-3.9,;-4.42,-1.59,;-3.09,-.82,;-1.75,-1.59,;-.29,2.92,;-1.62,3.69,;1.05,3.69,;2.38,2.92,;3.87,3.31,;4.27,1.83,;5.6,1.06,;5.75,2.23,;2.78,1.43,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,wD:17.19,5.4,35.39,7.32,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.38,3.19,;-.59,-1.49,;.32,-2.73,;1.81,-3.13,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-6.05,-1.19,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:8.8,31.34,33.38,wD:16.18,5.4,7.31,33.37,(4.57,-2.98,;3.48,-1.89,;3.88,-.4,;4.97,-1.49,;1.99,-2.29,;.9,-1.2,;.9,.34,;-.56,.82,;-1.47,-.43,;-2.96,-.03,;-4.04,-1.12,;-5.53,-.72,;-5.93,.77,;-4.84,1.86,;-5.24,3.34,;-3.35,1.46,;-.56,-1.67,;.34,-2.92,;1.83,-3.32,;-.56,-4.17,;-2.03,-3.69,;-3.36,-4.46,;-4.7,-3.69,;-6.03,-4.46,;-4.7,-2.15,;-6.03,-1.38,;-3.36,-1.38,;-2.03,-2.15,;-.56,2.36,;-1.9,3.13,;.77,3.13,;2.31,3.13,;3.4,4.22,;4.49,3.13,;5.26,4.46,;6.03,3.13,;3.4,2.04,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC2CCCC2)[C@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(Cl)c1F |r,wU:29.34,wD:19.21,1.0,10.10,12.13,(6.05,1.99,;4.57,2.39,;4.17,3.87,;2.68,4.27,;1.59,3.18,;1.99,1.7,;3.48,1.3,;.1,3.58,;-.99,2.49,;-2.47,2.89,;-.59,1.01,;.88,.53,;.88,-1.01,;2.21,-1.78,;3.54,-1.01,;4.02,.45,;5.56,.45,;6.04,-1.01,;4.79,-1.92,;-.59,-1.49,;.32,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2c1ccc(Cl)c2F)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,32.35,34.39,wD:7.32,34.38,(4.92,-1.65,;3.83,-.56,;4.23,.93,;5.32,-.16,;2.34,-.96,;1.25,.13,;1.25,1.67,;-.21,2.15,;-1.12,.9,;-2.6,1.3,;-3.69,.21,;-5.18,.61,;-5.58,2.1,;-4.49,3.18,;-4.89,4.67,;-3,2.79,;-3,4.33,;-.21,-.35,;.69,-1.59,;2.18,-1.99,;-.21,-2.84,;-1.68,-2.36,;-1.68,-.82,;-3.01,-.05,;-4.34,-.82,;-4.34,-2.36,;-5.68,-3.13,;-3.01,-3.13,;-3.01,-4.67,;-.21,3.69,;-1.54,4.46,;1.12,4.46,;2.46,3.69,;3.94,4.08,;4.34,2.6,;5.68,3.37,;5.68,1.83,;2.86,2.2,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,5.4,wD:16.29,7.31,34.38,(3.92,-4.64,;3.15,-3.31,;3.92,-1.98,;4.69,-3.31,;1.61,-3.31,;.84,-1.98,;1.32,-.51,;.07,.39,;-1.17,-.51,;-2.26,.58,;-3.75,.18,;-4.84,1.27,;-4.44,2.76,;-2.95,3.15,;-2.56,4.64,;-1.87,2.07,;-.7,-1.98,;-.22,-3.44,;1.26,-3.84,;-1.47,-4.34,;-2.71,-3.44,;-4.22,-3.76,;-5.25,-2.62,;-6.74,-3.01,;-4.78,-1.15,;-5.86,-.06,;-3.27,-.83,;-2.24,-1.98,;.07,1.93,;-1.26,2.7,;1.4,2.7,;2.74,1.93,;4.07,2.7,;5.41,1.93,;5.41,.39,;6.74,-.38,;4.07,-.38,;2.74,.39,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@@H](c2ccccc2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:19.32,20.23,12.13,wD:10.10,1.0,(6.48,3.51,;4.94,3.51,;4.17,4.85,;2.63,4.85,;1.86,3.51,;2.63,2.18,;4.17,2.18,;.32,3.51,;-1.01,2.74,;-2.35,3.51,;-1.01,1.2,;.45,.73,;.45,-.81,;1.7,-1.72,;3.1,-1.09,;4.35,-2,;4.19,-3.53,;2.78,-4.15,;1.69,-3.4,;-1.01,-1.29,;-1.92,-.04,;-3.41,.36,;-4.5,-.73,;-5.98,-.33,;-6.38,1.15,;-5.29,2.24,;-5.69,3.73,;-3.81,1.84,;-3.41,3.33,;-.11,-2.53,;1.38,-2.93,;-1.01,-3.78,;-2.48,-3.3,;-3.81,-4.07,;-5.15,-3.3,;-6.48,-4.07,;-5.15,-1.76,;-3.81,-.99,;-2.48,-1.76,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@@H](c2ccccc2)[C@]2([C@H]1Cc1ccccc1)C(=O)Nc1cc(Cl)ccc21 |r,wU:19.31,20.23,12.13,wD:10.10,1.0,(6.37,1.03,;4.89,1.43,;4.49,2.91,;3,3.31,;1.91,2.22,;2.31,.73,;3.8,.34,;.42,2.62,;-.91,1.85,;-2.24,2.62,;-.91,.31,;.56,-.16,;.56,-1.7,;1.8,-2.61,;3.21,-1.98,;4.45,-2.89,;4.29,-4.42,;2.89,-5.05,;1.79,-4.3,;-.91,-2.18,;-1.81,-.94,;-3.34,-.9,;-4.12,.4,;-5.66,.37,;-6.46,1.69,;-5.71,3.04,;-4.17,3.07,;-3.38,1.75,;-0,-3.43,;1.48,-3.82,;-.91,-4.67,;-2.37,-4.2,;-3.71,-4.97,;-5.04,-4.2,;-6.37,-4.97,;-5.04,-2.66,;-3.71,-1.89,;-2.37,-2.66,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](Cc2ccccc2)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:16.18,5.4,8.8,wD:7.30,33.37,(3.53,-4.75,;3.13,-3.27,;4.22,-2.18,;4.62,-3.67,;1.64,-2.87,;.56,-1.78,;.56,-.24,;-.91,.24,;-1.81,-1.01,;-3.35,-1.01,;-4.12,.32,;-5.66,.32,;-6.43,1.66,;-5.66,2.99,;-4.12,2.99,;-3.35,1.66,;-.91,-2.25,;-0,-3.5,;1.48,-3.9,;-.91,-4.75,;-2.37,-4.27,;-3.71,-5.04,;-5.04,-4.27,;-6.37,-5.04,;-5.04,-2.73,;-3.71,-1.96,;-2.37,-2.73,;-.91,1.78,;-2.24,2.55,;.42,2.55,;1.91,2.15,;3,3.24,;4.49,2.84,;4.89,1.35,;6.37,.95,;3.8,.26,;2.31,.66,)|
CCN1[C@@H](CC(C)(C)C)[C@]2([C@H]([C@@H]1C(=O)N[C@H]1C[C@@](C)(O)C1)c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:9.31,3.3,15.15,17.19,10.22,wD:11.12,17.18,(3.57,.86,;2.1,1.94,;1.25,.71,;1.25,-.83,;2.34,-1.91,;3.83,-1.52,;4.92,-2.61,;4.23,-.03,;5.32,-1.12,;-.21,-1.3,;-1.12,-.06,;-.21,1.19,;-.21,2.73,;-1.54,3.5,;1.12,3.5,;2.46,2.73,;3.94,3.13,;4.34,1.64,;5.68,2.41,;5.68,.87,;2.86,1.24,;-2.45,.71,;-3.54,-.37,;-5.03,.02,;-5.42,1.51,;-4.34,2.6,;-4.73,4.09,;-2.85,2.2,;-3.25,3.69,;.69,-2.55,;2.18,-2.95,;-.21,-3.79,;-1.68,-3.32,;-3.01,-4.09,;-4.34,-3.32,;-5.68,-4.09,;-4.34,-1.78,;-3.01,-1.01,;-1.68,-1.78,)|
CN1[C@@H](CC(C)(C)C)[C@]2([C@H]([C@@H]1C(=O)N[C@H]1C[C@@](C)(O)C1)c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:8.30,2.2,14.14,16.18,9.21,wD:10.11,16.17,(2.79,.71,;1.25,.71,;1.25,-.83,;2.34,-1.91,;3.83,-1.52,;4.92,-2.61,;4.23,-.03,;5.32,-1.12,;-.21,-1.3,;-1.12,-.06,;-.21,1.19,;-.21,2.73,;-1.54,3.5,;1.12,3.5,;2.46,2.73,;3.94,3.13,;4.34,1.64,;5.68,2.41,;5.68,.87,;2.86,1.24,;-2.45,.71,;-3.54,-.37,;-5.03,.02,;-5.42,1.51,;-4.34,2.6,;-4.73,4.09,;-2.85,2.2,;-3.25,3.69,;.69,-2.55,;2.18,-2.95,;-.21,-3.79,;-1.68,-3.32,;-3.01,-4.09,;-4.34,-3.32,;-5.68,-4.09,;-4.34,-1.78,;-3.01,-1.01,;-1.68,-1.78,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(F)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:8.8,31.34,33.38,wD:17.19,5.4,7.31,33.37,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,wD:17.19,5.4,34.38,7.31,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.38,3.19,;-.59,-1.49,;.32,-2.73,;1.81,-3.13,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:8.8,30.33,32.37,wD:16.18,5.4,7.30,32.36,(4.92,-2.42,;3.83,-1.33,;4.23,.16,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-.21,-1.12,;.69,-2.36,;2.18,-2.76,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,2.6,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(F)c2F)[C@@]11C(=O)Nc2c1ccc(Cl)c2F)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:8.8,32.35,34.39,wD:17.19,5.4,7.32,34.38,(4.57,-2.21,;3.48,-1.12,;3.88,.37,;4.97,-.72,;1.99,-1.52,;.9,-.43,;.9,1.11,;-.56,1.59,;-1.47,.34,;-2.96,.74,;-4.04,-.35,;-5.53,.05,;-5.93,1.54,;-4.84,2.63,;-5.24,4.11,;-3.35,2.23,;-3.35,3.77,;-.56,-.9,;.34,-2.15,;1.83,-2.55,;-.56,-3.4,;-2.03,-2.92,;-2.03,-1.38,;-3.36,-.61,;-4.7,-1.38,;-4.7,-2.92,;-6.03,-3.69,;-3.36,-3.69,;-3.36,-5.23,;-.56,3.13,;-1.9,3.9,;.77,3.9,;2.31,3.9,;3.4,4.99,;4.49,3.9,;5.26,5.23,;6.03,3.9,;3.4,2.81,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@H](O)CC1 |r,wU:8.8,5.4,wD:17.19,34.38,7.31,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(F)c2F)[C@]11C(=O)Nc2c1ccc(Cl)c2F)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,32.35,34.39,wD:7.32,34.38,(4.92,-1.65,;3.83,-.56,;4.23,.93,;5.32,-.16,;2.34,-.96,;1.25,.13,;1.25,1.67,;-.21,2.15,;-1.12,.9,;-2.6,1.3,;-3.69,.21,;-5.18,.61,;-5.58,2.1,;-4.49,3.18,;-4.89,4.67,;-3,2.79,;-3,4.33,;-.21,-.35,;.69,-1.59,;2.18,-1.99,;-.21,-2.84,;-1.68,-2.36,;-1.68,-.82,;-3.01,-.05,;-4.34,-.82,;-4.34,-2.36,;-5.68,-3.13,;-3.01,-3.13,;-3.01,-4.67,;-.21,3.69,;-1.54,4.46,;1.12,4.46,;2.46,3.69,;3.94,4.08,;4.34,2.6,;5.68,3.37,;5.68,1.83,;2.86,2.2,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@](C)(O)CC1 |r,wU:17.19,8.8,5.4,34.39,wD:7.31,34.38,(4.54,-2.79,;3.45,-1.7,;3.85,-.21,;4.94,-1.3,;1.97,-2.1,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;2.68,4.27,;4.17,3.87,;4.57,2.39,;5.65,3.47,;6.05,1.99,;3.48,1.3,;1.99,1.7,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cc(F)cc(Cl)c2)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,8.8,5.4,31.34,33.38,wD:7.31,33.37,(5.22,-2.42,;4.13,-1.33,;4.53,.16,;5.61,-.93,;2.64,-1.73,;1.55,-.64,;1.55,.9,;.09,1.38,;-.82,.13,;-2.31,.53,;-2.71,2.02,;-4.19,2.41,;-4.59,3.9,;-5.28,1.33,;-4.88,-.16,;-5.97,-1.25,;-3.4,-.56,;.09,-1.12,;.99,-2.36,;2.48,-2.76,;.09,-3.61,;-1.38,-3.13,;-2.71,-3.9,;-4.05,-3.13,;-5.38,-3.9,;-4.05,-1.59,;-2.71,-.82,;-1.38,-1.59,;.09,2.92,;-1.25,3.69,;1.42,3.69,;2.75,2.92,;4.24,3.31,;4.64,1.83,;5.97,2.6,;5.97,1.06,;3.15,1.43,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@](C)(O)CC1 |r,wU:17.19,8.8,5.4,34.38,wD:7.31,34.39,(4.12,-2.98,;3.03,-1.89,;3.43,-.4,;4.51,-1.49,;1.54,-2.29,;.45,-1.2,;.45,.34,;-1.01,.82,;-1.92,-.43,;-3.41,-.03,;-4.5,-1.12,;-5.98,-.72,;-6.38,.77,;-5.29,1.86,;-5.69,3.34,;-3.81,1.46,;-3.81,3,;-1.01,-1.67,;-.11,-2.92,;1.38,-3.32,;-1.01,-4.17,;-2.48,-3.69,;-3.81,-4.46,;-5.15,-3.69,;-6.48,-4.46,;-5.15,-2.15,;-3.81,-1.38,;-2.48,-2.15,;-1.01,2.36,;-2.35,3.13,;.32,3.13,;1.86,3.13,;2.63,1.79,;4.17,1.79,;4.94,3.13,;6.48,3.13,;5.71,4.46,;4.17,4.46,;2.63,4.46,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cc(Cl)ccc2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:17.19,5.4,31.34,33.38,8.8,wD:7.31,33.37,(4.92,-2.92,;3.83,-1.83,;4.23,-.34,;5.32,-1.43,;2.34,-2.23,;1.25,-1.14,;1.25,.4,;-.21,.88,;-1.12,-.37,;-2.45,.4,;-1.68,1.73,;-2.45,3.07,;-1.68,4.4,;-3.99,3.07,;-4.76,1.73,;-3.99,.4,;-4.76,-.93,;-.21,-1.62,;.69,-2.86,;2.18,-3.26,;-.21,-4.11,;-1.68,-3.63,;-3.01,-4.4,;-4.34,-3.63,;-5.68,-4.4,;-4.34,-2.09,;-3.01,-1.32,;-1.68,-2.09,;-.21,2.42,;-1.54,3.19,;1.12,3.19,;2.46,2.42,;3.94,2.81,;4.34,1.33,;5.68,2.1,;5.68,.56,;2.86,.93,)|
COc1ccc(F)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1cccc(F)c1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |(4.68,5.6,;3.91,4.26,;4.68,2.93,;6.22,2.93,;6.99,1.6,;6.22,.26,;4.68,.26,;3.91,-1.07,;3.91,1.6,;2.37,1.6,;1.46,2.84,;,2.37,;-1.46,2.84,;-2.23,4.18,;-2.37,1.6,;-1.46,.35,;,.83,;1.46,.35,;1.86,-1.14,;.77,-2.22,;3.35,-1.53,;-1.86,-1.14,;-.77,-2.22,;-1.17,-3.71,;-2.66,-4.11,;-3.06,-5.6,;-3.75,-3.02,;-3.35,-1.53,;-4.44,-.45,;-3.91,1.6,;-4.68,.26,;-6.22,.26,;-6.99,-1.07,;-6.99,1.6,;-6.22,2.93,;-4.68,2.93,;-3.91,4.26,)|
CC(C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)-c1ccccc1OC(F)(F)F
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C#N
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)c(OC)n1
COc1ncccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N(C)C
CNC(=O)c1ccc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NCCO
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NC(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N1CCOCC1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N1CC(O)C1
COc1cnccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(CN)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(CNC(C)=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(CO)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(CO)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1ccc(CO)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1cc(CO)ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1cc(CO)ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(=O)N(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C#N
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(=O)N1CCOCC1
COc1cc(ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C#N
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1
COc1cc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)nn1
COc1ccc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)c(OC)n1
COc1ncncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1
COc1ccc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1
CCc1nc(OC)ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
CCc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C#N
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)N(C)C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N(C)C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N(C)CCO
COc1nc(NCCO)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1cc(Cl)ccc1C
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)[N+]#[C-])c2cc(Cl)ccc2C)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1cc(Cl)ccc1C)N(C)C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1cc(Cl)c(=O)n(C)c1)N(C)C
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)[N+]#[C-])c2cc(Cl)c(=O)n(C)c2)c(OC)n1
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1cc(Cl)c(=O)n(C)c1
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)c(OC)n1
CCc1nc(OC)ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
CCc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C#N
COc1ncncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)N(C)CCO
COc1nc(NCCO)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1cccc(Cl)c1F
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)[N+]#[C-])c2cccc(Cl)c2F)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1cccc(Cl)c1F)N(C)C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1ccc(F)c(Cl)c1
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)[N+]#[C-])c2ccc(F)c(Cl)c2)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)[N+]#[C-])c1ccc(F)c(Cl)c1)N(C)C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N1CC(C)(O)C1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)N1CC(C)(O)C1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N1CC(O)C1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)N1CC(O)C1
COc1cc(CN)ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)c(=O)n(C)c2)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)N(C)C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)C(=O)N(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)C(=O)N1CCOCC1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)C(=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cncc(Cl)c2)c(OC)n1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1)C(=O)N(C)C
COc1cc(ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N(C)C
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)c(OC)n1 |r|
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
CC(C)n1c(nc2C(=O)N(C(c12)c1ccc(cc1)C#N)c1cc(Cl)ccc1C)-c1ccccc1O
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)C#N)c2cccc(Cl)c2F)c(OC)n1
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1ccc(F)c(Cl)c1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1ccc(F)c(Cl)c1)C(=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)C#N)c2ccc(F)c(Cl)c2)c(OC)n1
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CCC(=O)N(C)C1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)C2CCC(=O)N(C)C2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C2CCC2)c2ccc(Cl)cc2)c2ccc(F)c(Cl)c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C2CCC2)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C2CCC2)c2ccc(cc2)C#N)c2ccc(F)c(Cl)c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C2CC2)c2ccc(Cl)cc2)c2ccc(F)c(Cl)c2)c(OC)n1
COc1ccc(CO)cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |r|
COc1ccc(CO)cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |r|
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)nn1C)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(C)nn2C)c(OC)n1
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(cc1C)C(N)=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc(cc2C)C(N)=O)c(OC)n1
COc1c[nH]c(=O)nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)[C@H]2CC[C@@H](CC2)C(O)=O)c(OC)n1 |r,wU:25.27,wD:28.34,(9.3,.26,;8.53,1.6,;6.99,1.6,;6.22,.26,;4.68,.26,;3.91,1.6,;2.37,1.6,;1.46,2.84,;,2.37,;-1.46,2.84,;-2.23,4.18,;-2.37,1.6,;-1.46,.35,;,.83,;1.46,.35,;1.86,-1.14,;.77,-2.22,;3.35,-1.53,;-1.86,-1.14,;-3.35,-1.53,;-3.75,-3.02,;-2.66,-4.11,;-3.06,-5.6,;-1.17,-3.71,;-.77,-2.22,;-3.91,1.6,;-4.68,.26,;-6.22,.26,;-6.99,1.6,;-6.22,2.93,;-4.68,2.93,;-8.53,1.6,;-9.3,.26,;-9.3,2.93,;4.68,2.93,;3.91,4.26,;4.68,5.6,;6.22,2.93,)|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)[C@H]2CC[C@@H](CC2)NC(C)=O)c(OC)n1 |r,wU:25.27,wD:28.34,(10.07,.26,;9.3,1.6,;7.76,1.6,;6.99,.26,;5.45,.26,;4.68,1.6,;3.14,1.6,;2.23,2.84,;.77,2.37,;-.69,2.84,;-1.46,4.18,;-1.6,1.6,;-.69,.35,;.77,.83,;2.23,.35,;2.63,-1.14,;1.54,-2.22,;4.12,-1.53,;-1.09,-1.14,;-2.58,-1.53,;-2.98,-3.02,;-1.89,-4.11,;-2.29,-5.6,;-.4,-3.71,;-0,-2.22,;-3.14,1.6,;-3.91,.26,;-5.45,.26,;-6.22,1.6,;-5.45,2.93,;-3.91,2.93,;-7.76,1.6,;-8.53,.26,;-10.07,.26,;-7.76,-1.07,;5.45,2.93,;4.68,4.26,;5.45,5.6,;6.99,2.93,)|
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O)N(C)C
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cn(C)c2=O)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cn(C)c2=O)c(OC)n1 |r|
CNC(=O)[C@H]1CC[C@@H](CC1)N1C(c2c(nc(-c3cnc(OC)nc3OC)n2C(C)C)C1=O)c1ccc(Cl)cc1 |r,wU:7.10,wD:4.3,(-8.53,-1.07,;-9.3,.26,;-8.53,1.6,;-9.3,2.93,;-6.99,1.6,;-6.22,.26,;-4.68,.26,;-3.91,1.6,;-4.68,2.93,;-6.22,2.93,;-2.37,1.6,;-1.46,.35,;,.83,;,2.37,;1.46,2.84,;2.37,1.6,;3.91,1.6,;4.68,.26,;6.22,.26,;6.99,1.6,;8.53,1.6,;9.3,.26,;6.22,2.93,;4.68,2.93,;3.91,4.26,;4.68,5.6,;1.46,.35,;1.86,-1.14,;.77,-2.22,;3.35,-1.53,;-1.46,2.84,;-2.23,4.18,;-1.86,-1.14,;-3.35,-1.53,;-3.75,-3.02,;-2.66,-4.11,;-3.06,-5.6,;-1.17,-3.71,;-.77,-2.22,)|
COc1cn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O
COc1cn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1cn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)-c1cnc(OC)nc1OC |r|
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)N(C)CCO
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1[C@H](C)CO)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N(C)C |r|
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)N(C)CCO
COc1ncc(-c2nc3C(=O)N(C([C@H]4CC[C@H](C)CC4)c3n2C(C)C)c2cc(Cl)ccc2C)c(OC)n1 |r,wU:13.12,wD:16.16,(8.14,.26,;7.37,1.6,;5.83,1.6,;5.06,.26,;3.52,.26,;2.75,1.6,;1.21,1.6,;.31,2.84,;-1.15,2.37,;-2.62,2.84,;-3.39,4.18,;-3.52,1.6,;-2.62,.35,;-3.02,-1.14,;-1.93,-2.22,;-2.33,-3.71,;-3.82,-4.11,;-4.21,-5.6,;-4.9,-3.02,;-4.51,-1.53,;-1.15,.83,;.31,.35,;.71,-1.14,;-.38,-2.22,;2.2,-1.53,;-5.06,1.6,;-5.83,.26,;-7.37,.26,;-8.14,-1.07,;-8.14,1.6,;-7.37,2.93,;-5.83,2.93,;-5.06,4.26,;3.52,2.93,;2.75,4.26,;3.52,5.6,;5.06,2.93,)|
CCOC(=O)C1(N(C(=O)c2nc(-c3cnc(OC)nc3OC)n(C(C)C)c12)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
COc1ncc(-c2nc3C(=O)N(C(c3n2[C@H](C)CO)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1 |r|
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(cc1C)C#N
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc(cc2C)C#N)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C#N)c(OC)n1
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N(C)CCO
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cnc2O)c(OC)n1
CNC(=O)N1CCC(CC1)N1C(c2c(nc(-c3cnc(OC)nc3OC)n2C(C)C)C1=O)c1ccc(Cl)cc1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2)C#N)c2cc(Cl)cn(C)c2=O)c(OC)n1
COC(=O)N1CCC(CC1)N1C(c2c(nc(-c3cnc(OC)nc3OC)n2C(C)C)C1=O)c1ccc(Cl)cc1
CNC(=O)Cc1cc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cccc(Cl)c2F)c(OC)cn1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cnc(O)c(Cl)c1)N(C)C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CN(C)C(=O)N(C)C1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)C1CN(C)C(=O)N(C)C1)N(C)C
COc1ccc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F
COc1ncc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
COc1ncc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F
COc1ncc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
CCOC(=O)Cc1cnc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
COc1ncc(CC(O)=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(N)=O
COc1ncc(CC(O)=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cnc(O)c(Cl)c2)c(OC)n1
COc1nc(N)ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F |r|
CC(C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)-c1cccc(c1)-c1c[nH]c(C)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)C2CN(C)C(=O)N(C)C2)c(OC)n1
COc1ncc(CC(O)=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
CNC(=O)Cc1cnc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
CNC(=O)Cc1cnc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F
COc1ncc(-c2nc3C(=O)N(C(c3n2[C@@H](C)CO)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1 |r|
CCOC(=O)Cc1cnc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F
CNC(=O)Cc1cnc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
CCOC(=O)Cc1cnc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1ncc(-c2nc3C(=O)N(c4cc(Cl)ccc4C)C(C)(c3n2C(C)C)c2ccc(Cl)cc2C)c(OC)n1
CNC(=O)Cc1ccc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C
COc1ccc(CC(=O)N(C)C)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COC[C@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)-c1cnc(OC)nc1OC |r,w:11.11|
CNC(=O)Cc1ccc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cnc1O)N(C)C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O
COc1nc(ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1nc(ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1ccc(CC(O)=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1nc(ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cnc1O)N(C)C |r|
COc1nc(ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cnc1O)N(C)C |r|
COC(=O)Cc1ccc(OC)c(c1)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(cc2)C#N)c2cccc(Cl)c2F)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(C#N)c(F)c2)c2ccc(F)c(Cl)c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1 |r|
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C#N
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)N(C)C
COc1cnc(nc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)N(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)C(N)=O
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)C(N)=O
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(N)=O
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cnc2O)c(OC)n1
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)c[nH]c2=O)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cn(C)c(=O)n(C)c1=O)N(C)C
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cn(C)c(=O)n(C)c1=O
COc1ncc(-c2nc3C(=O)N(C(c3n2C2CC2)c2ccc(Cl)cc2)c2cc(Cl)ccc2C)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2C)C#N)c2cccc(Cl)c2F)c(OC)n1
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1C)C#N)c1cccc(Cl)c1F
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)N(C)C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)N(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1C)C#N)c1cc(Cl)ccc1C)C(=O)N(C)C
CCn1cc(OC)c(cc1=O)-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(cc2C)C#N)c2cc(Cl)ccc2C)c(OC)n1
COc1ccc(cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(=O)N(C)C |r|
COc1ccc(cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(=O)N(C)C |r|
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1C)C#N)c1cc(Cl)ccc1C
COc1nc(N)ncc1C1=NC2C(C(N(C2=O)c2cccc(Cl)c2F)c2ccc(Cl)cc2)N1C(C)C |t:10|
COc1nc(N)ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)C#N
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)C(=O)N1CCOCC1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)N(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)C(=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc(F)c(Cl)c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(cc2)C#N)c2cccc(Cl)c2F)c(OC)n1 |r|
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)C(=O)N(C)C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)N1CC(O)C1
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cn(C)c2=O)c(OC)n1
COc1nc(N)ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C |r|
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cncc(Cl)c1)C(=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cccc(Cl)c2F)c(OC)n1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)C(=O)NC(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cccc(Cl)c2)c(OC)n1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1)C#N
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1)C(=O)N1CCOCC1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2C)c2cccc(Cl)c2)c(OC)n1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1)C#N
COc1ccc(cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NCCO |r|
COc1ccc(cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NCCO |r|
COc1cc(ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NCCO
COc1cc(ccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NC(C)C
CCc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N(C)C |r|
COc1ccc(cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N(C)C |r|
COc1ccc(CO)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccn1
COc1ccc(cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NC(C)C |r|
COc1ccc(cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NC(C)C |r|
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)cnc1C
COc1ccc(CNC(=O)CO)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(CCO)c1
COCCn1cc(cc(Cl)c1=O)N1C(c2c(nc(-c3ccccc3OC)n2C(C)C)C1=O)c1ccc(Cl)cc1C
COc1ccccc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1
CCn1cc(cc(Cl)c1=O)N1C(c2c(nc(-c3ccccc3OC)n2C(C)C)C1=O)c1ccc(Cl)cc1C
CC(C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cccc(Cl)c1F)-c1ccnc(N)c1
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)C(O)C(C)C
COc1ccc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)C(C)O
COc1nnc(cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F)C(=O)N(C)C
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)cn(C)c1=O
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1C)C#N)c1cccc(Cl)c1F
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1ccc(F)c(Cl)c1
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1
COc1cnc(CC#N)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1C)C#N)c1cc(Cl)ccc1C
COc1cn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)nc(C)n1
COc1nn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cn1)c1cc(Cl)ccc1C)N(C)C
CNc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(C#N)c(F)c2)c2cccc(Cl)c2F)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(C#N)c(F)c1)c1cccc(Cl)c1F)N(C)C
COc1cnc(CC#N)cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F |r|
COc1cnc(CC#N)cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F |r|
COc1cnc(CC#N)cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C |r|
COc1cnc(CC#N)cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)ccc1C |r|
COc1cnc(CC#N)cc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F |r|
COc1cnc(CC#N)cc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(cc1)C#N)c1cccc(Cl)c1F)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(cc1)C#N)c1cc(Cl)ccc1C)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cccc(Cl)c1F)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)-c1cnc(OC)nc1OC |r|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc(F)c(C)c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(C)ccc2OC)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(C)nc(C)n2)c(OC)n1
COc1nc(N)ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1 |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1 |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F |r|
COc1nc(N)ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F |r|
COc1cn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(C)c1
COc1ccc(C)cc1N1C(c2c(nc(-c3cc(=O)n(C)cc3OC)n2C(C)C)C1=O)c1ccc(Cl)cc1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cn2)c2cc(Cl)ccc2C)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(C#N)c(F)c1)c1cc(Cl)cn(C)c1=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(C#N)c(F)c2)c2cc(Cl)cn(C)c2=O)c(OC)n1
CC(C)n1c(nc2C(=O)N([C@H](c12)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)-c1c[nH]c(=O)[nH]c1=O |r|
COc1nc(ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1nc(ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cnc2O)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)c[nH]c2=O)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)c(F)c2)c2cc(Cl)cn(C)c2=O)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)cn(C)c1=O)N(C)C
COc1ncc(-c2nc3C(=O)N(c4cc(Cl)cn(C)c4=O)C(C)(c3n2C(C)C)c2ccc(Cl)cc2)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)c(=O)n(C)c1)N(C)C
COc1nc(ncc1-c1nc2C(=O)N([C@@H](c2n1C(C)C)c1ccc(C#N)c(F)c1)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1nc(ncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(C#N)c(F)c1)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)c(F)c2)c2cc(Cl)c(=O)n(C)c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(C)cc(=O)n2C)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(C)cn(C)c2=O)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(C)cn(C)c1=O)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)c(=O)n(c2)C(F)F)c(OC)n1
CCn1cc(Cl)cc(N2C(c3c(nc(-c4cnc(OC)nc4OC)n3C(C)C)C2=O)c2ccc(Cl)cc2)c1=O
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)cn(C)c2=O)c(OC)n1
COc1nc(=O)[nH]cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(C)nnc2OC)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cnc2OC)c(OC)n1
COc1nnc(C)cc1N1C(c2c(nc(-c3cnc(nc3OC)N(C)C)n2C(C)C)C1=O)c1ccc(Cl)cc1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1F)c1cccc(Cl)c1F)N(C)C
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2F)c2cc(Cl)cn(C)c2=O)c(OC)n1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1F)c1cc(Cl)cn(C)c1=O)N(C)C
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1c(F)c(C)nn1C)N(C)C
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)c(=O)n(C)c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)c(=O)n(C)c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2c(F)c(nn2C)C2CC2)c(OC)n1
COc1cn(C)c(=O)cc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(Cl)cc1)c1c(F)c(nn1C)C1CC1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F)N1CCS(=O)(=O)CC1
COc1nc(ncc1-c1nc2C(=O)N(C(c2n1C(C)C)c1ccc(cc1)C#N)c1cccc(Cl)c1F)N1CCC[C@H](O)C1 |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)-c1cnc(N)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)ccc1C)-c1cnc(N)nc1OC |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2[C@H](C)CO)c2ccc(Cl)cc2)c2cccc(Cl)c2F)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@H](c3n2[C@H](C)CO)c2ccc(Cl)cc2)c2cccc(Cl)c2F)c(OC)n1 |r|
COC[C@@H](C)n1c(nc2C(=O)N([C@H](c12)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N([C@@H](c12)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)-c1cnc(nc1OC)N(C)C |r|
COC[C@@H](C)n1c(nc2C(=O)N([C@H](c12)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N([C@@H](c12)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)-c1cnc(OC)nc1OC |r|
COC[C@@H](C)n1c(nc2C(=O)N([C@H](c12)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)-c1cnc(nc1OC)N(C)C |r|
COC[C@@H](C)n1c(nc2C(=O)N([C@@H](c12)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)-c1cnc(nc1OC)N(C)C |r|
CC(C)c1ccnc(c1)-c1nc2c(C)c(nc(N[C@H](C)C3CCC3)c2n1Cc1ccc(cc1)C(F)(F)F)C(O)=O |r|
CC(C)c1ccnc(c1)-c1nc2cc(nc(N[C@H](C)C3CCC3)c2n1Cc1ccc(cc1)C(F)(F)F)C(O)=O |r|
C[C@@H](Nc1nc(cc2nc(-c3cccc(C)c3)n(Cc3ccc(cc3)C(F)(F)F)c12)C(O)=O)C1CCC1 |r|
CC(C)c1ccnc(c1)-c1nc2cc(nc(N[C@H](C)C3CCC3)c2n1Cc1ccc(C)cc1)C(O)=O |r|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cccc(C)c4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,33.38,(7.86,-3.92,;6.37,-3.52,;5.98,-2.03,;4.49,-1.63,;3.4,-2.72,;1.91,-2.32,;1.51,-.83,;2.42,.41,;1.51,1.66,;.05,1.18,;-1.28,1.95,;-2.62,1.18,;-2.62,-.36,;-1.28,-1.13,;-1.28,-2.67,;.05,-3.44,;.05,-4.98,;-1.28,-5.75,;-2.62,-4.98,;-3.95,-5.75,;-2.62,-3.44,;.05,-.36,;-3.95,1.95,;-3.95,3.49,;-5.42,3.97,;-6.32,2.72,;-7.86,2.72,;-5.42,1.48,;3.96,.41,;4.73,-.92,;6.27,-.92,;7.04,.41,;6.27,1.75,;4.73,1.75,;3.96,3.08,;4.73,4.41,;3.96,5.75,;2.42,5.75,;1.65,4.41,;2.42,3.08,;3.8,-4.21,;5.29,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cccc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cccc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC[C@H]2CF)CC1 |r,wU:4.4,wD:1.0,32.37,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;3.32,3.21,;4.09,4.55,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,32.36,wD:1.0,36.39,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2C(F)(F)F)CC1 |r,wU:4.4,wD:1.0,(7.86,-3.03,;6.37,-2.63,;5.98,-1.14,;4.49,-.74,;3.4,-1.83,;1.91,-1.43,;1.51,.06,;2.42,1.3,;1.51,2.55,;.05,2.07,;-1.28,2.84,;-2.62,2.07,;-2.62,.53,;-1.28,-.24,;-1.28,-1.78,;.05,-2.55,;.05,-4.09,;-1.28,-4.86,;-2.62,-4.09,;-3.95,-4.86,;-2.62,-2.55,;.05,.53,;-3.95,2.84,;-3.95,4.38,;-5.42,4.86,;-6.32,3.61,;-7.86,3.61,;-5.42,2.37,;3.96,1.3,;4.86,.06,;6.33,.53,;6.33,2.07,;4.87,2.64,;4.42,4.11,;3.97,5.58,;2.95,3.66,;5.89,4.57,;3.8,-3.32,;5.29,-3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC3CCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC3CCCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCOC3CCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
COC(C)(C)[C@@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:30.34,5.4,(3.32,5.7,;4.09,4.37,;3.32,3.04,;1.99,2.27,;1.99,3.81,;4.09,1.7,;5.56,1.23,;5.56,-.31,;4.09,-.79,;3.19,.46,;1.65,.46,;.74,1.7,;-.72,1.23,;-2.05,2,;-3.39,1.23,;-3.39,-.31,;-2.05,-1.08,;-2.05,-2.62,;-.72,-3.39,;-.72,-4.93,;-2.05,-5.7,;-3.39,-4.93,;-4.72,-5.7,;-3.39,-3.39,;-.72,-.31,;.74,-.79,;1.14,-2.28,;2.63,-2.68,;3.72,-1.59,;5.21,-1.99,;5.6,-3.47,;7.09,-3.87,;4.52,-4.56,;3.03,-4.16,;-4.72,2,;-6.19,1.52,;-7.09,2.77,;-6.19,4.01,;-6.96,5.35,;-4.72,3.54,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCC[C@H]2CF)CC1 |r,wU:4.4,wD:1.0,32.37,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;3.32,3.21,;4.09,4.55,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@H]3CCC[C@H]23)CC1 |r,wU:4.4,36.39,wD:1.0,32.36,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCOC3CCCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
COC(C)(C)[C@@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1n[nH]c(=O)o1 |r,wU:27.30,wD:30.34,5.4,(6.27,4.06,;4.78,4.46,;3.7,3.37,;2.61,4.46,;2.21,2.97,;4.09,1.88,;5.56,1.41,;5.56,-.13,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCO[C@H]3CCC[C@H]23)CC1 |r,wU:4.4,36.39,wD:1.0,32.36,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,32.36,wD:1.0,36.39,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)COC[C@H]2C)CC1 |r,wU:4.4,34.39,wD:29.33,1.0,(6.49,-5.56,;5.16,-4.79,;5.16,-3.25,;3.82,-2.48,;2.49,-3.25,;1.16,-2.48,;1.16,-.58,;2.06,.67,;1.16,1.91,;-.31,1.44,;-1.64,2.21,;-2.98,1.44,;-2.98,-.1,;-1.64,-.87,;-1.64,-2.41,;-.31,-3.18,;-.31,-4.72,;-1.64,-5.49,;-2.98,-4.72,;-4.31,-5.49,;-2.98,-3.18,;-.31,-.1,;-4.31,2.21,;-5.78,1.73,;-6.68,2.98,;-5.78,4.22,;-6.55,5.56,;-4.31,3.75,;3.6,.67,;4.37,2,;3.6,3.34,;5.91,2,;6.68,.67,;5.91,-.67,;4.37,-.67,;3.6,-2,;2.49,-4.79,;3.82,-5.56,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2[C@H](C)COC[C@H]2C)CC1 |r,wU:4.4,34.39,wD:29.33,1.0,(6.49,-5.56,;5.16,-4.79,;5.16,-3.25,;3.82,-2.48,;2.49,-3.25,;1.16,-2.48,;1.16,-.58,;2.06,.67,;1.16,1.91,;-.31,1.44,;-1.64,2.21,;-2.98,1.44,;-2.98,-.1,;-1.64,-.87,;-1.64,-2.41,;-.31,-3.18,;-.31,-4.72,;-1.64,-5.49,;-2.98,-4.72,;-4.31,-5.49,;-2.98,-3.18,;-.31,-.1,;-4.31,2.21,;-5.78,1.73,;-6.68,2.98,;-5.78,4.22,;-6.55,5.56,;-4.31,3.75,;3.6,.67,;4.37,2,;3.6,3.34,;5.91,2,;6.68,.67,;5.91,-.67,;4.37,-.67,;3.6,-2,;2.49,-4.79,;3.82,-5.56,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCC[C@H]2C(F)(F)F)CC1 |r,wU:4.4,wD:1.0,32.37,(7.86,-3.2,;6.37,-2.81,;5.98,-1.32,;4.49,-.92,;3.4,-2.01,;1.91,-1.61,;1.51,-.12,;2.42,1.12,;1.51,2.37,;.05,1.89,;-1.28,2.66,;-2.62,1.89,;-2.62,.35,;-1.28,-.42,;-1.28,-1.96,;.05,-2.73,;.05,-4.27,;-1.28,-5.04,;-2.62,-4.27,;-3.95,-5.04,;-2.62,-2.73,;.05,.35,;-3.95,2.66,;-3.95,4.2,;-5.42,4.68,;-6.32,3.43,;-7.86,3.43,;-5.42,2.19,;3.96,1.12,;4.86,-.12,;6.33,.35,;6.33,1.89,;4.86,2.37,;4.09,3.7,;4.86,5.04,;3.32,5.04,;2.55,3.7,;3.8,-3.5,;5.29,-3.89,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(O)=O)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,30.34,(6.57,-3.92,;5.09,-3.52,;4.69,-2.03,;3.2,-1.63,;2.11,-2.72,;.62,-2.32,;.23,-.83,;1.13,.41,;.23,1.66,;-1.24,1.18,;-2.57,1.95,;-3.91,1.18,;-3.91,-.36,;-2.57,-1.13,;-2.57,-2.67,;-1.24,-3.44,;-1.24,-4.98,;-2.57,-5.75,;-3.91,-4.98,;-5.24,-5.75,;-3.91,-3.44,;-1.24,-.36,;-5.24,1.95,;-6.57,1.18,;-5.24,3.49,;2.67,.41,;3.44,-.92,;4.98,-.92,;5.75,.41,;4.98,1.75,;3.44,1.75,;2.67,3.08,;3.44,4.41,;2.67,5.75,;1.13,5.75,;.36,4.41,;1.13,3.08,;2.51,-4.21,;4,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2C)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;3.96,1.97,;3.19,3.3,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@@H](C)COC[C@@H]2C)CC1 |r,wU:29.33,4.4,wD:1.0,34.39,(6.49,-5.56,;5.16,-4.79,;5.16,-3.25,;3.82,-2.48,;2.49,-3.25,;1.16,-2.48,;1.16,-.58,;2.06,.67,;1.16,1.91,;-.31,1.44,;-1.64,2.21,;-2.98,1.44,;-2.98,-.1,;-1.64,-.87,;-1.64,-2.41,;-.31,-3.18,;-.31,-4.72,;-1.64,-5.49,;-2.98,-4.72,;-4.31,-5.49,;-2.98,-3.18,;-.31,-.1,;-4.31,2.21,;-5.78,1.73,;-6.68,2.98,;-5.78,4.22,;-6.55,5.56,;-4.31,3.75,;3.6,.67,;4.37,2,;3.6,3.34,;5.91,2,;6.68,.67,;5.91,-.67,;4.37,-.67,;3.6,-2,;2.49,-4.79,;3.82,-5.56,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC3CCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC3C2C3C(F)(F)F)CC1 |r,wU:1.0,wD:4.4,(7.04,-3.86,;5.56,-3.46,;4.47,-4.55,;2.98,-4.15,;2.58,-2.67,;1.09,-2.27,;.69,-.78,;1.6,.47,;.69,1.71,;-.77,1.24,;-2.1,2.01,;-3.44,1.24,;-3.44,-.3,;-2.1,-1.07,;-2.1,-2.61,;-.77,-3.38,;-.77,-4.92,;-2.1,-5.69,;-3.44,-4.92,;-4.77,-5.69,;-3.44,-3.38,;-.77,-.3,;-4.77,2.01,;-6.24,1.53,;-7.14,2.78,;-6.24,4.02,;-7.01,5.36,;-4.77,3.55,;3.14,.47,;4.04,-.78,;5.51,-.3,;5.51,1.24,;4.04,1.71,;5.19,2.74,;5.66,4.21,;6.06,5.69,;7.14,3.77,;4.19,4.64,;3.67,-1.58,;5.16,-1.98,)|
CCC1COCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:28.32,wD:25.28,(1.65,3.3,;3.19,3.3,;3.96,1.97,;5.5,1.97,;6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC3CC23)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.98,-.7,;5.52,-.7,;6.29,.64,;5.52,1.97,;4.75,3.3,;3.98,1.97,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(C)OCC2C)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.98,-.7,;5.52,-.7,;6.29,-2.03,;6.29,.64,;5.52,1.97,;3.98,1.97,;3.21,3.31,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCOCC2C)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.86,-.75,;5.36,-1.09,;6.56,-.13,;6.56,1.41,;5.36,2.37,;3.86,2.02,;2.9,3.23,;3.72,-1.41,;5.21,-1.81,)|
CC(C)C1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:28.32,wD:25.28,(4.09,4.55,;3.32,3.21,;1.78,3.21,;4.09,1.88,;5.56,1.41,;5.56,-.13,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@@H]1CC[C@@H](C)N1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.31,4.4,wD:24.27,1.0,(3,3.22,;3.77,1.89,;5.23,1.41,;5.23,-.13,;3.77,-.6,;3,-1.94,;2.86,.64,;1.32,.64,;.42,1.89,;-1.05,1.41,;-2.38,2.18,;-3.71,1.41,;-3.71,-.13,;-2.38,-.9,;-2.38,-2.44,;-1.05,-3.21,;-1.05,-4.75,;-2.38,-5.52,;-3.71,-4.75,;-5.05,-5.52,;-3.71,-3.21,;-1.05,-.13,;.42,-.6,;1.47,-3.25,;2.95,-3.65,;3.35,-5.13,;4.84,-5.53,;5.93,-4.44,;7.42,-4.84,;5.53,-2.95,;4.04,-2.56,;-5.05,2.18,;-6.51,1.71,;-7.42,2.95,;-6.51,4.2,;-7.28,5.53,;-5.05,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(O)=O)N2CCC[C@H]2C(F)(F)F)CC1 |r,wU:4.4,wD:1.0,29.33,(6.57,-3.2,;5.09,-2.81,;4.69,-1.32,;3.2,-.92,;2.11,-2.01,;.62,-1.61,;.23,-.12,;1.13,1.12,;.23,2.37,;-1.24,1.89,;-2.57,2.66,;-3.91,1.89,;-3.91,.35,;-2.57,-.42,;-2.57,-1.96,;-1.24,-2.73,;-1.24,-4.27,;-2.57,-5.04,;-3.91,-4.27,;-5.24,-5.04,;-3.91,-2.73,;-1.24,.35,;-5.24,2.66,;-6.57,1.89,;-5.24,4.2,;2.67,1.12,;3.58,-.12,;5.04,.35,;5.04,1.89,;3.58,2.37,;2.81,3.7,;3.58,5.04,;1.27,3.7,;2.04,5.04,;2.51,-3.5,;4,-3.89,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOCC2c2ccccc2F)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.45,;5.16,-4.68,;5.16,-3.14,;3.82,-2.37,;2.49,-3.14,;1.16,-2.37,;1.16,-.83,;2.06,.41,;1.16,1.66,;-.31,1.18,;-1.64,1.95,;-2.98,1.18,;-2.98,-.36,;-1.64,-1.13,;-1.64,-2.67,;-.31,-3.44,;-.31,-4.98,;-1.64,-5.75,;-2.98,-4.98,;-4.31,-5.75,;-2.98,-3.44,;-.31,-.36,;-4.31,1.95,;-5.78,1.48,;-6.68,2.72,;-5.78,3.97,;-6.55,5.3,;-4.31,3.49,;3.6,.41,;4.37,-.92,;5.91,-.92,;6.68,.41,;5.91,1.75,;4.37,1.75,;3.6,3.08,;2.06,3.08,;1.29,4.41,;2.06,5.75,;3.6,5.75,;4.37,4.41,;5.91,4.41,;2.49,-4.68,;3.82,-5.45,)|
COC(C)C1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:29.33,(3.83,5.7,;4.6,4.37,;3.83,3.04,;2.29,3.04,;4.6,1.7,;6.07,1.23,;6.07,-.31,;4.6,-.79,;3.7,.46,;2.16,.46,;1.25,1.7,;-.21,1.23,;-1.55,2,;-2.88,1.23,;-2.88,-.31,;-1.55,-1.08,;-1.55,-2.62,;-.21,-3.39,;-.21,-4.93,;-1.55,-5.7,;-2.88,-4.93,;-4.22,-5.7,;-2.88,-3.39,;-.21,-.31,;1.25,-.79,;1.25,-2.33,;2.58,-3.1,;3.92,-2.33,;5.25,-3.1,;5.25,-4.64,;6.59,-5.41,;3.92,-5.41,;2.58,-4.64,;-4.22,2,;-5.68,1.52,;-6.59,2.77,;-5.68,4.01,;-6.45,5.35,;-4.22,3.54,)|
CC1CCN(C1C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.31,wD:24.27,(6.89,2.18,;5.56,1.41,;5.56,-.13,;4.09,-.61,;3.19,.64,;4.09,1.88,;3.32,3.21,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2C2CC2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;3.32,3.21,;3.32,4.75,;1.99,3.98,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2C(C)(C)C)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;3.32,3.21,;4.09,4.55,;1.78,3.21,;2.55,4.55,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC22CCC2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;4.79,3.25,;3.42,3.95,;2.72,2.58,;3.72,-1.41,;5.21,-1.81,)|
CCC(C)(C)C1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.34,wD:27.30,(5.63,4.55,;4.09,4.55,;3.32,3.21,;1.78,3.21,;2.55,4.55,;4.09,1.88,;5.56,1.41,;5.56,-.13,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2nonc2C)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.78,;5.6,-3.38,;4.52,-4.47,;3.03,-4.08,;2.63,-2.59,;1.14,-2.19,;.74,-.7,;1.65,.54,;.74,1.79,;-.72,1.31,;-2.05,2.08,;-3.39,1.31,;-3.39,-.23,;-2.05,-1,;-2.05,-2.54,;-.72,-3.31,;-.72,-4.85,;-2.05,-5.62,;-3.39,-4.85,;-4.72,-5.62,;-3.39,-3.31,;-.72,-.23,;-4.72,2.08,;-6.19,1.61,;-7.09,2.85,;-6.19,4.1,;-6.96,5.43,;-4.72,3.62,;3.19,.54,;4.09,-.7,;5.56,-.23,;5.56,1.31,;4.09,1.79,;3.32,3.12,;1.86,3.6,;1.86,5.14,;3.32,5.62,;4.23,4.37,;5.77,4.37,;3.72,-1.5,;5.21,-1.9,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC[C@H]2C)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;3.96,1.97,;3.19,3.3,;3.03,-3.98,;4.52,-4.38,)|
C[C@@H]1C[C@@H](O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.27,3.3,wD:27.31,1.0,(3.32,3.21,;4.09,1.88,;5.56,1.41,;5.56,-.13,;6.89,-.9,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(O)=O)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,29.32,wD:1.0,33.35,(6.57,-3.1,;5.09,-2.7,;4.69,-1.21,;3.2,-.81,;2.11,-1.9,;.62,-1.51,;.23,-.02,;1.13,1.23,;.23,2.47,;-1.24,2,;-2.57,2.77,;-3.91,2,;-3.91,.46,;-2.57,-.31,;-2.57,-1.85,;-1.24,-2.62,;-1.24,-4.16,;-2.57,-4.93,;-3.91,-4.16,;-5.24,-4.93,;-3.91,-2.62,;-1.24,.46,;-5.24,2.77,;-6.57,2,;-5.24,4.31,;2.67,1.23,;3.46,-.11,;5,-.11,;5.77,1.23,;5,2.56,;5.47,4.03,;4.23,4.93,;2.98,4.03,;3.46,2.56,;2.51,-3.39,;4,-3.79,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(O)=O)N2CCC[C@H]2CF)CC1 |r,wU:4.4,wD:1.0,29.33,(6.57,-3.16,;5.09,-2.76,;4.69,-1.27,;3.2,-.87,;2.11,-1.96,;.62,-1.56,;.23,-.08,;1.13,1.17,;.23,2.41,;-1.24,1.94,;-2.57,2.71,;-3.91,1.94,;-3.91,.4,;-2.57,-.37,;-2.57,-1.91,;-1.24,-2.68,;-1.24,-4.22,;-2.57,-4.99,;-3.91,-4.22,;-5.24,-4.99,;-3.91,-2.68,;-1.24,.4,;-5.24,2.71,;-6.57,1.94,;-5.24,4.25,;2.67,1.17,;3.58,-.08,;5.04,.4,;5.04,1.94,;3.58,2.41,;3.18,3.9,;4.27,4.99,;2.51,-3.45,;4,-3.85,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(C)OCC2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,-2.25,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
CO[C@@H]1C[C@@H](C)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.28,2.1,wD:28.32,4.4,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;2.76,3.21,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.58,-2.1,;2.06,-2.5,;3.15,-1.41,;4.64,-1.81,;5.04,-3.29,;6.53,-3.69,;3.95,-4.38,;2.46,-3.98,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(cc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC3COCC23)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC[C@@H]2C(=O)N(C)C)CC1 |r,wU:1.0,32.37,wD:4.4,(7.09,-3.9,;5.6,-3.5,;4.52,-4.59,;3.03,-4.19,;2.63,-2.71,;1.14,-2.31,;.74,-.82,;1.65,.43,;.74,1.67,;-.72,1.2,;-2.05,1.97,;-3.39,1.2,;-3.39,-.34,;-2.05,-1.11,;-2.05,-2.65,;-.72,-3.42,;-.72,-4.96,;-2.05,-5.73,;-3.39,-4.96,;-4.72,-5.73,;-3.39,-3.42,;-.72,-.34,;-4.72,1.97,;-6.19,1.49,;-7.09,2.74,;-6.19,3.98,;-6.96,5.31,;-4.72,3.51,;3.19,.43,;4.09,-.82,;5.56,-.34,;5.56,1.2,;4.09,1.67,;3.7,3.16,;2.21,3.56,;4.78,4.25,;4.39,5.73,;6.27,3.85,;3.72,-1.62,;5.21,-2.02,)|
CCN(C)C(=O)[C@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:31.35,6.5,wD:28.31,(6.67,2.36,;6.27,3.85,;4.78,4.25,;4.39,5.73,;3.7,3.16,;2.21,3.56,;4.09,1.67,;5.56,1.2,;5.56,-.34,;4.09,-.82,;3.19,.43,;1.65,.43,;.74,1.67,;-.72,1.2,;-2.05,1.97,;-3.39,1.2,;-3.39,-.34,;-2.05,-1.11,;-2.05,-2.65,;-.72,-3.42,;-.72,-4.96,;-2.05,-5.73,;-3.39,-4.96,;-4.72,-5.73,;-3.39,-3.42,;-.72,-.34,;.74,-.82,;1.14,-2.31,;2.63,-2.71,;3.03,-4.19,;4.52,-4.59,;5.6,-3.5,;7.09,-3.9,;5.21,-2.02,;3.72,-1.62,;-4.72,1.97,;-6.19,1.49,;-7.09,2.74,;-6.19,3.98,;-6.96,5.31,;-4.72,3.51,)|
CCc1noc(C)c1C1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:33.38,wD:30.34,(6.91,5.74,;6.14,4.4,;4.6,4.4,;3.7,5.65,;2.23,5.17,;2.23,3.63,;.9,2.86,;3.7,3.16,;4.09,1.67,;5.56,1.19,;5.56,-.35,;4.09,-.82,;3.19,.42,;1.65,.42,;.74,1.67,;-.72,1.19,;-2.05,1.96,;-3.39,1.19,;-3.39,-.35,;-2.05,-1.12,;-2.05,-2.66,;-.72,-3.43,;-.72,-4.97,;-2.05,-5.74,;-3.39,-4.97,;-4.72,-5.74,;-3.39,-3.43,;-.72,-.35,;.74,-.82,;1.14,-2.31,;2.63,-2.71,;3.03,-4.2,;4.52,-4.59,;5.6,-3.51,;7.09,-3.9,;5.21,-2.02,;3.72,-1.62,;-4.72,1.96,;-6.19,1.49,;-7.09,2.73,;-6.19,3.98,;-6.96,5.31,;-4.72,3.5,)|
CC(C)OCC1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.34,wD:27.30,(.32,5.24,;1.81,4.85,;2.9,5.93,;2.21,3.36,;3.7,2.96,;4.09,1.47,;5.56,1,;5.56,-.54,;4.09,-1.02,;3.19,.23,;1.65,.23,;.74,1.47,;-.72,1,;-2.05,1.77,;-3.39,1,;-3.39,-.54,;-2.05,-1.31,;-2.05,-2.85,;-.72,-3.62,;-.72,-5.16,;-2.05,-5.93,;-3.39,-5.16,;-4.72,-5.93,;-3.39,-3.62,;-.72,-.54,;.74,-1.02,;1.14,-2.51,;2.63,-2.91,;3.03,-4.39,;4.52,-4.79,;5.6,-3.7,;7.09,-4.1,;5.21,-2.22,;3.72,-1.82,;-4.72,1.77,;-6.19,1.29,;-7.09,2.54,;-6.19,3.78,;-6.96,5.12,;-4.72,3.31,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2COC(F)(F)F)CC1 |r,wU:1.0,wD:4.4,(7.09,-4.1,;5.6,-3.7,;4.52,-4.79,;3.03,-4.39,;2.63,-2.91,;1.14,-2.51,;.74,-1.02,;1.65,.23,;.74,1.47,;-.72,1,;-2.05,1.77,;-3.39,1,;-3.39,-.54,;-2.05,-1.31,;-2.05,-2.85,;-.72,-3.62,;-.72,-5.16,;-2.05,-5.93,;-3.39,-5.16,;-4.72,-5.93,;-3.39,-3.62,;-.72,-.54,;-4.72,1.77,;-6.19,1.29,;-7.09,2.54,;-6.19,3.78,;-6.96,5.12,;-4.72,3.31,;3.19,.23,;4.09,-1.02,;5.56,-.54,;5.56,1,;4.09,1.47,;3.7,2.96,;2.21,3.36,;1.81,4.85,;.32,5.24,;2.9,5.93,;.72,3.76,;3.72,-1.82,;5.21,-2.22,)|
C[C@@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.30,wD:23.26,1.0,(3.7,3.37,;4.09,1.88,;5.56,1.41,;5.56,-.13,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
COC[C@@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:28.32,wD:25.28,3.2,(1.81,5.25,;2.21,3.77,;3.7,3.37,;4.09,1.88,;5.56,1.41,;5.56,-.13,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC[C@H]2C(F)F)CC1 |r,wU:1.0,wD:4.4,32.37,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;3.7,3.37,;2.21,3.77,;4.78,4.46,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC(C)C2C)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.68,3.3,;4.37,1.97,;3.6,3.3,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC22CCOC2)CC1 |r,wU:4.4,wD:1.0,(6.59,-5.23,;5.25,-4.46,;5.25,-2.92,;3.92,-2.15,;2.58,-2.92,;1.25,-2.15,;1.25,-.61,;2.16,.64,;1.25,1.88,;-.21,1.41,;-1.55,2.18,;-2.88,1.41,;-2.88,-.13,;-1.55,-.9,;-1.55,-2.44,;-.21,-3.21,;-.21,-4.75,;-1.55,-5.52,;-2.88,-4.75,;-4.22,-5.52,;-2.88,-3.21,;-.21,-.13,;-4.22,2.18,;-5.68,1.7,;-6.59,2.95,;-5.68,4.19,;-6.45,5.52,;-4.22,3.72,;3.7,.64,;4.6,-.61,;6.07,-.13,;6.07,1.41,;4.6,1.88,;3.14,2.36,;3.14,3.9,;4.6,4.37,;5.51,3.13,;2.58,-4.46,;3.92,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC22CCOCC2)CC1 |r,wU:4.4,wD:1.0,(6.59,-5.23,;5.25,-4.46,;5.25,-2.92,;3.92,-2.15,;2.58,-2.92,;1.25,-2.15,;1.25,-.61,;2.16,.64,;1.25,1.88,;-.21,1.41,;-1.55,2.18,;-2.88,1.41,;-2.88,-.13,;-1.55,-.9,;-1.55,-2.44,;-.21,-3.21,;-.21,-4.75,;-1.55,-5.52,;-2.88,-4.75,;-4.22,-5.52,;-2.88,-3.21,;-.21,-.13,;-4.22,2.18,;-5.68,1.7,;-6.59,2.95,;-5.68,4.19,;-6.45,5.52,;-4.22,3.72,;3.7,.64,;4.6,-.61,;6.07,-.13,;6.07,1.41,;4.6,1.88,;5.63,3.03,;5.16,4.49,;3.65,4.81,;2.62,3.67,;3.09,2.2,;2.58,-4.46,;3.92,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC3COCCC23)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2cnn[nH]2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.86,;5.6,-3.46,;4.52,-4.55,;3.03,-4.15,;2.63,-2.66,;1.14,-2.27,;.74,-.78,;1.65,.47,;.74,1.71,;-.72,1.24,;-2.05,2.01,;-3.39,1.24,;-3.39,-.3,;-2.05,-1.07,;-2.05,-2.61,;-.72,-3.38,;-.72,-4.92,;-2.05,-5.69,;-3.39,-4.92,;-4.72,-5.69,;-3.39,-3.38,;-.72,-.3,;-4.72,2.01,;-6.19,1.53,;-7.09,2.78,;-6.19,4.02,;-6.96,5.36,;-4.72,3.55,;3.19,.47,;4.09,-.78,;5.56,-.3,;5.56,1.24,;4.09,1.71,;3.7,3.2,;2.23,3.68,;2.23,5.22,;3.7,5.69,;4.6,4.45,;3.72,-1.58,;5.21,-1.97,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2ncn(C)n2)CC1 |r,wU:1.0,wD:4.4,(7.09,-4.01,;5.6,-3.61,;4.52,-4.7,;3.03,-4.3,;2.63,-2.81,;1.14,-2.41,;.74,-.93,;1.65,.32,;.74,1.57,;-.72,1.09,;-2.05,1.86,;-3.39,1.09,;-3.39,-.45,;-2.05,-1.22,;-2.05,-2.76,;-.72,-3.53,;-.72,-5.07,;-2.05,-5.84,;-3.39,-5.07,;-4.72,-5.84,;-3.39,-3.53,;-.72,-.45,;-4.72,1.86,;-6.19,1.38,;-7.09,2.63,;-6.19,3.88,;-6.96,5.21,;-4.72,3.4,;3.19,.32,;4.09,-.93,;5.56,-.45,;5.56,1.09,;4.09,1.57,;3.7,3.05,;4.6,4.3,;3.7,5.55,;2.23,5.07,;.9,5.84,;2.23,3.53,;3.72,-1.72,;5.21,-2.12,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2ncnn2C)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.86,;5.6,-3.46,;4.52,-4.55,;3.03,-4.15,;2.63,-2.66,;1.14,-2.27,;.74,-.78,;1.65,.47,;.74,1.71,;-.72,1.24,;-2.05,2.01,;-3.39,1.24,;-3.39,-.3,;-2.05,-1.07,;-2.05,-2.61,;-.72,-3.38,;-.72,-4.92,;-2.05,-5.69,;-3.39,-4.92,;-4.72,-5.69,;-3.39,-3.38,;-.72,-.3,;-4.72,2.01,;-6.19,1.53,;-7.09,2.78,;-6.19,4.02,;-6.96,5.36,;-4.72,3.55,;3.19,.47,;4.09,-.78,;5.56,-.3,;5.56,1.24,;4.09,1.71,;3.7,3.2,;2.23,3.68,;2.23,5.22,;3.7,5.69,;4.6,4.45,;6.14,4.45,;3.72,-1.58,;5.21,-1.97,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2nccs2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.86,;5.6,-3.46,;4.52,-4.55,;3.03,-4.15,;2.63,-2.66,;1.14,-2.27,;.74,-.78,;1.65,.47,;.74,1.71,;-.72,1.24,;-2.05,2.01,;-3.39,1.24,;-3.39,-.3,;-2.05,-1.07,;-2.05,-2.61,;-.72,-3.38,;-.72,-4.92,;-2.05,-5.69,;-3.39,-4.92,;-4.72,-5.69,;-3.39,-3.38,;-.72,-.3,;-4.72,2.01,;-6.19,1.53,;-7.09,2.78,;-6.19,4.02,;-6.96,5.36,;-4.72,3.55,;3.19,.47,;4.09,-.78,;5.56,-.3,;5.56,1.24,;4.09,1.71,;3.7,3.2,;2.23,3.68,;2.23,5.22,;3.7,5.69,;4.6,4.45,;3.72,-1.58,;5.21,-1.97,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2cc(C)no2)CC1 |r,wU:1.0,wD:4.4,(7.09,-4.01,;5.6,-3.61,;4.52,-4.7,;3.03,-4.3,;2.63,-2.81,;1.14,-2.41,;.74,-.93,;1.65,.32,;.74,1.57,;-.72,1.09,;-2.05,1.86,;-3.39,1.09,;-3.39,-.45,;-2.05,-1.22,;-2.05,-2.76,;-.72,-3.53,;-.72,-5.07,;-2.05,-5.84,;-3.39,-5.07,;-4.72,-5.84,;-3.39,-3.53,;-.72,-.45,;-4.72,1.86,;-6.19,1.38,;-7.09,2.63,;-6.19,3.88,;-6.96,5.21,;-4.72,3.4,;3.19,.32,;4.09,-.93,;5.56,-.45,;5.56,1.09,;4.09,1.57,;3.7,3.05,;2.23,3.53,;2.23,5.07,;.9,5.84,;3.7,5.55,;4.6,4.3,;3.72,-1.72,;5.21,-2.12,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2c(C)noc2C)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.86,;5.6,-3.46,;4.52,-4.55,;3.03,-4.15,;2.63,-2.66,;1.14,-2.27,;.74,-.78,;1.65,.47,;.74,1.71,;-.72,1.24,;-2.05,2.01,;-3.39,1.24,;-3.39,-.3,;-2.05,-1.07,;-2.05,-2.61,;-.72,-3.38,;-.72,-4.92,;-2.05,-5.69,;-3.39,-4.92,;-4.72,-5.69,;-3.39,-3.38,;-.72,-.3,;-4.72,2.01,;-6.19,1.53,;-7.09,2.78,;-6.19,4.02,;-6.96,5.36,;-4.72,3.55,;3.19,.47,;4.09,-.78,;5.56,-.3,;5.56,1.24,;4.09,1.71,;3.7,3.2,;4.6,4.45,;6.14,4.45,;3.7,5.69,;2.23,5.22,;2.23,3.68,;.9,2.91,;3.72,-1.58,;5.21,-1.97,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2nc(C)no2)CC1 |r,wU:1.0,wD:4.4,(7.09,-4.01,;5.6,-3.61,;4.52,-4.7,;3.03,-4.3,;2.63,-2.81,;1.14,-2.41,;.74,-.93,;1.65,.32,;.74,1.57,;-.72,1.09,;-2.05,1.86,;-3.39,1.09,;-3.39,-.45,;-2.05,-1.22,;-2.05,-2.76,;-.72,-3.53,;-.72,-5.07,;-2.05,-5.84,;-3.39,-5.07,;-4.72,-5.84,;-3.39,-3.53,;-.72,-.45,;-4.72,1.86,;-6.19,1.38,;-7.09,2.63,;-6.19,3.88,;-6.96,5.21,;-4.72,3.4,;3.19,.32,;4.09,-.93,;5.56,-.45,;5.56,1.09,;4.09,1.57,;3.7,3.05,;2.23,3.53,;2.23,5.07,;.9,5.84,;3.7,5.55,;4.6,4.3,;3.72,-1.72,;5.21,-2.12,)|
CCNC(=O)[C@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.34,5.4,wD:27.30,(5.47,6.28,;4.39,5.19,;4.78,3.7,;3.7,2.61,;2.21,3.01,;4.09,1.13,;5.56,.65,;5.56,-.89,;4.09,-1.37,;3.19,-.12,;1.65,-.12,;.74,1.13,;-.72,.65,;-2.05,1.42,;-3.39,.65,;-3.39,-.89,;-2.05,-1.66,;-2.05,-3.2,;-.72,-3.97,;-.72,-5.51,;-2.05,-6.28,;-3.39,-5.51,;-4.72,-6.28,;-3.39,-3.97,;-.72,-.89,;.74,-1.37,;1.14,-2.85,;2.63,-3.25,;3.03,-4.74,;4.52,-5.14,;5.6,-4.05,;7.09,-4.45,;5.21,-2.56,;3.72,-2.16,;-4.72,1.42,;-6.19,.94,;-7.09,2.19,;-6.19,3.44,;-6.96,4.77,;-4.72,2.96,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(=O)N(C)C[C@H]2C)CC1 |r,wU:4.4,wD:1.0,35.40,(6.73,-3.69,;5.25,-3.29,;4.85,-1.81,;3.36,-1.41,;2.27,-2.5,;.78,-2.1,;.39,-.61,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,;2.83,.64,;3.6,-.7,;5.14,-.7,;6.47,-1.47,;5.91,.64,;7.45,.64,;5.14,1.97,;3.6,1.97,;2.83,3.3,;2.67,-3.98,;4.16,-4.38,)|
COC1CC[C@@H](C)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:29.33,5.5,(7.45,-2.03,;5.91,-2.03,;5.14,-.7,;5.91,.64,;5.14,1.97,;3.6,1.97,;2.83,3.3,;2.83,.64,;3.6,-.7,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;.39,-.61,;.39,-2.15,;1.72,-2.92,;3.05,-2.15,;4.39,-2.92,;4.39,-4.46,;5.72,-5.23,;3.05,-5.23,;1.72,-4.46,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCS(=O)(=O)CC2C)CC1 |r,wU:4.4,wD:1.0,(6.84,-3.69,;5.35,-3.29,;4.95,-1.81,;3.46,-1.41,;2.37,-2.5,;.89,-2.1,;.49,-.61,;1.39,.64,;.49,1.88,;-.98,1.41,;-2.31,2.18,;-3.64,1.41,;-3.64,-.13,;-2.31,-.9,;-2.31,-2.44,;-.98,-3.21,;-.98,-4.75,;-2.31,-5.52,;-3.64,-4.75,;-4.98,-5.52,;-3.64,-3.21,;-.98,-.13,;-4.98,2.18,;-6.44,1.7,;-7.35,2.95,;-6.44,4.19,;-7.21,5.52,;-4.98,3.72,;2.93,.64,;3.7,-.7,;5.24,-.7,;6.01,.64,;7.35,1.41,;7.35,-.13,;5.24,1.97,;3.7,1.97,;2.93,3.3,;2.77,-3.98,;4.26,-4.38,)|
COC1CC2CCC1N2c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.30,wD:29.34,TLB:1:2:6.5:8,THB:9:8:2.3:6.5,(8,2.14,;7.23,.8,;5.69,.8,;4.76,2.04,;3.81,.82,;3.6,-.7,;4.52,-1.93,;4.74,-.41,;2.28,.64,;.74,.64,;-.16,1.88,;-1.63,1.41,;-2.96,2.18,;-4.29,1.41,;-4.29,-.13,;-2.96,-.9,;-2.96,-2.44,;-1.63,-3.21,;-1.63,-4.75,;-2.96,-5.52,;-4.29,-4.75,;-5.63,-5.52,;-4.29,-3.21,;-1.63,-.13,;-.16,-.61,;-.16,-2.15,;1.17,-2.92,;2.51,-2.15,;3.84,-2.92,;3.84,-4.46,;5.17,-5.23,;2.51,-5.23,;1.17,-4.46,;-5.63,2.18,;-7.09,1.7,;-8,2.95,;-7.09,4.19,;-7.86,5.52,;-5.63,3.72,)|
CO[C@@H]1C[C@@H](C(C)C)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,2.1,wD:30.34,4.4,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;3.13,3.37,;1.64,3.77,;4.22,4.46,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.18,-2.15,;1.51,-2.92,;2.84,-2.15,;4.18,-2.92,;4.18,-4.46,;5.51,-5.23,;2.84,-5.23,;1.51,-4.46,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
CC(C)C1C[C@@H](O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,5.5,wD:29.33,(4.88,4.46,;3.8,3.37,;2.31,3.77,;4.19,1.88,;5.66,1.41,;5.66,-.13,;6.99,-.9,;4.19,-.61,;3.29,.64,;1.75,.64,;.84,1.88,;-.62,1.41,;-1.95,2.18,;-3.29,1.41,;-3.29,-.13,;-1.95,-.9,;-1.95,-2.44,;-.62,-3.21,;-.62,-4.75,;-1.95,-5.52,;-3.29,-4.75,;-4.62,-5.52,;-3.29,-3.21,;-.62,-.13,;.84,-.61,;.84,-2.15,;2.18,-2.92,;3.51,-2.15,;4.84,-2.92,;4.84,-4.46,;6.18,-5.23,;3.51,-5.23,;2.18,-4.46,;-4.62,2.18,;-6.09,1.7,;-6.99,2.95,;-6.09,4.19,;-6.86,5.52,;-4.62,3.72,)|
CO[C@@H]1C[C@@H](CF)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,2.1,wD:29.33,4.4,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;2.76,3.21,;3.53,4.55,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.18,-2.15,;1.51,-2.92,;2.84,-2.15,;4.18,-2.92,;4.18,-4.46,;5.51,-5.23,;2.84,-5.23,;1.51,-4.46,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
CO[C@@H]1C[C@H](CF)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,2.1,4.4,wD:29.33,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;2.76,3.21,;3.53,4.55,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.18,-2.15,;1.51,-2.92,;2.84,-2.15,;4.18,-2.92,;4.18,-4.46,;5.51,-5.23,;2.84,-5.23,;1.51,-4.46,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N(C)CC(F)(F)F)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;3.96,1.97,;3.19,3.3,;3.96,4.64,;4.68,2.9,;1.7,3.7,;3.72,-1.41,;5.21,-1.81,)|
CO[C@H]1COC[C@@H]1N(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:6.7,26.29,wD:2.1,29.33,(7.45,.64,;5.91,.64,;5.14,1.97,;5.62,3.43,;4.37,4.34,;3.12,3.43,;3.6,1.97,;2.83,.64,;3.6,-.7,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;.39,-.61,;.78,-2.1,;2.27,-2.5,;3.36,-1.41,;4.85,-1.81,;5.25,-3.29,;6.73,-3.69,;4.16,-4.38,;2.67,-3.98,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2cn(C)nn2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.93,;5.6,-3.53,;4.52,-4.62,;3.03,-4.22,;2.63,-2.73,;1.14,-2.34,;.74,-.85,;1.65,.4,;.74,1.64,;-.72,1.17,;-2.05,1.94,;-3.39,1.17,;-3.39,-.37,;-2.05,-1.14,;-2.05,-2.68,;-.72,-3.45,;-.72,-4.99,;-2.05,-5.76,;-3.39,-4.99,;-4.72,-5.76,;-3.39,-3.45,;-.72,-.37,;-4.72,1.94,;-6.19,1.46,;-7.09,2.71,;-6.19,3.95,;-6.96,5.29,;-4.72,3.48,;3.19,.4,;4.09,-.85,;5.56,-.37,;5.56,1.17,;4.09,1.64,;3.32,2.98,;1.86,3.45,;1.86,4.99,;.53,5.76,;3.32,5.47,;4.23,4.22,;3.72,-1.65,;5.21,-2.04,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC[C@H]2C(=O)N(C)C)CC1 |r,wU:1.0,wD:32.37,4.4,(7.09,-3.9,;5.6,-3.5,;4.52,-4.59,;3.03,-4.19,;2.63,-2.71,;1.14,-2.31,;.74,-.82,;1.65,.43,;.74,1.67,;-.72,1.2,;-2.05,1.97,;-3.39,1.2,;-3.39,-.34,;-2.05,-1.11,;-2.05,-2.65,;-.72,-3.42,;-.72,-4.96,;-2.05,-5.73,;-3.39,-4.96,;-4.72,-5.73,;-3.39,-3.42,;-.72,-.34,;-4.72,1.97,;-6.19,1.49,;-7.09,2.74,;-6.19,3.98,;-6.96,5.31,;-4.72,3.51,;3.19,.43,;4.09,-.82,;5.56,-.34,;5.56,1.2,;4.09,1.67,;3.7,3.16,;2.21,3.56,;4.78,4.25,;6.27,3.85,;4.39,5.73,;3.72,-1.62,;5.21,-2.02,)|
C[C@H]1CC[C@H](Cn2c(Nc3ccccc3F)nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;3.19,.64,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;6.27,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.72,-1.41,;5.21,-1.81,)|
CCn1nccc1C1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:32.37,wD:29.33,(6.54,5.66,;5.77,4.33,;4.23,4.33,;3.32,5.57,;1.86,5.1,;1.86,3.56,;3.32,3.08,;4.09,1.75,;5.56,1.27,;5.56,-.27,;4.09,-.75,;3.19,.5,;1.65,.5,;.74,1.75,;-.72,1.27,;-2.05,2.04,;-3.39,1.27,;-3.39,-.27,;-2.05,-1.04,;-2.05,-2.58,;-.72,-3.35,;-.72,-4.89,;-2.05,-5.66,;-3.39,-4.89,;-4.72,-5.66,;-3.39,-3.35,;-.72,-.27,;.74,-.75,;1.14,-2.23,;2.63,-2.63,;3.03,-4.12,;4.52,-4.52,;5.6,-3.43,;7.09,-3.83,;5.21,-1.94,;3.72,-1.54,;-4.72,2.04,;-6.19,1.56,;-7.09,2.81,;-6.19,4.06,;-6.96,5.39,;-4.72,3.58,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2cnn(C)c2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.93,;5.6,-3.53,;4.52,-4.62,;3.03,-4.22,;2.63,-2.73,;1.14,-2.34,;.74,-.85,;1.65,.4,;.74,1.64,;-.72,1.17,;-2.05,1.94,;-3.39,1.17,;-3.39,-.37,;-2.05,-1.14,;-2.05,-2.68,;-.72,-3.45,;-.72,-4.99,;-2.05,-5.76,;-3.39,-4.99,;-4.72,-5.76,;-3.39,-3.45,;-.72,-.37,;-4.72,1.94,;-6.19,1.46,;-7.09,2.71,;-6.19,3.95,;-6.96,5.29,;-4.72,3.48,;3.19,.4,;4.09,-.85,;5.56,-.37,;5.56,1.17,;4.09,1.64,;3.32,2.98,;4.23,4.22,;3.32,5.47,;1.86,4.99,;.53,5.76,;1.86,3.45,;3.72,-1.65,;5.21,-2.04,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2noc(C)n2)CC1 |r,wU:1.0,wD:4.4,(7.09,-4.45,;5.6,-4.05,;4.52,-5.14,;3.03,-4.74,;2.63,-3.25,;1.14,-2.86,;.74,-1.37,;1.65,-.12,;.74,1.12,;-.72,.65,;-2.05,1.42,;-3.39,.65,;-3.39,-.89,;-2.05,-1.66,;-2.05,-3.2,;-.72,-3.97,;-.72,-5.51,;-2.05,-6.28,;-3.39,-5.51,;-4.72,-6.28,;-3.39,-3.97,;-.72,-.89,;-4.72,1.42,;-6.19,.94,;-7.09,2.19,;-6.19,3.43,;-6.96,4.77,;-4.72,2.96,;3.19,-.12,;4.09,-1.37,;5.56,-.89,;5.56,.65,;4.09,1.12,;3.32,2.46,;1.86,2.93,;1.86,4.47,;3.32,4.95,;4.09,6.28,;4.23,3.7,;3.72,-2.17,;5.21,-2.56,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2nc(C)no2)CC1 |r,wU:1.0,wD:4.4,(6.59,-5.54,;5.25,-4.77,;3.92,-5.54,;2.58,-4.77,;2.58,-3.23,;1.25,-2.46,;1.25,-.92,;2.16,.33,;1.25,1.58,;-.21,1.1,;-1.55,1.87,;-2.88,1.1,;-2.88,-.44,;-1.55,-1.21,;-1.55,-2.75,;-.21,-3.52,;-.21,-5.06,;-1.55,-5.83,;-2.88,-5.06,;-4.22,-5.83,;-2.88,-3.52,;-.21,-.44,;-4.22,1.87,;-5.68,1.39,;-6.59,2.64,;-5.68,3.89,;-6.45,5.22,;-4.22,3.41,;3.7,.33,;4.6,-.92,;6.07,-.44,;6.07,1.1,;4.6,1.58,;3.83,2.91,;2.37,3.39,;2.37,4.93,;1.12,5.83,;3.83,5.4,;4.74,4.16,;3.92,-2.46,;5.25,-3.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC22COC2)CC1 |r,wU:1.0,wD:4.4,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.28,-.45,;5.37,.64,;4.28,1.72,;5.37,2.81,;4.28,3.9,;3.19,2.81,;3.72,-1.41,;5.21,-1.81,)|
COC(C)(C)CN(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:28.31,wD:25.27,(3.19,5.75,;3.96,4.41,;3.19,3.08,;1.65,3.08,;2.42,1.75,;3.96,1.75,;3.19,.41,;3.96,-.92,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;.74,-.83,;1.14,-2.32,;2.63,-2.72,;3.03,-4.21,;4.52,-4.61,;5.6,-3.52,;7.09,-3.92,;5.21,-2.03,;3.72,-1.63,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC2c2csc(C)n2)CC1 |r,wU:1.0,wD:4.4,(7.09,-4.45,;5.6,-4.05,;4.52,-5.14,;3.03,-4.74,;2.63,-3.25,;1.14,-2.86,;.74,-1.37,;1.65,-.12,;.74,1.12,;-.72,.65,;-2.05,1.42,;-3.39,.65,;-3.39,-.89,;-2.05,-1.66,;-2.05,-3.2,;-.72,-3.97,;-.72,-5.51,;-2.05,-6.28,;-3.39,-5.51,;-4.72,-6.28,;-3.39,-3.97,;-.72,-.89,;-4.72,1.42,;-6.19,.94,;-7.09,2.19,;-6.19,3.43,;-6.96,4.77,;-4.72,2.96,;3.19,-.12,;4.09,-1.37,;5.56,-.89,;5.56,.65,;4.09,1.12,;3.32,2.46,;1.86,2.93,;1.86,4.47,;3.32,4.95,;4.09,6.28,;4.23,3.7,;3.72,-2.17,;5.21,-2.56,)|
COCCN(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:23.25,(5.5,4.64,;6.27,3.3,;5.5,1.97,;3.96,1.97,;3.19,.64,;3.96,-.7,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCN(CCOC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:24.26,(5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;5.5,1.97,;6.27,3.3,;5.5,4.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC[C@H]2C(=O)N(C)C)CC1 |r,wU:1.0,wD:4.4,32.37,(7.09,-3.9,;5.6,-3.5,;4.52,-4.59,;3.03,-4.19,;2.63,-2.71,;1.14,-2.31,;.74,-.82,;1.65,.43,;.74,1.67,;-.72,1.2,;-2.05,1.97,;-3.39,1.2,;-3.39,-.34,;-2.05,-1.11,;-2.05,-2.65,;-.72,-3.42,;-.72,-4.96,;-2.05,-5.73,;-3.39,-4.96,;-4.72,-5.73,;-3.39,-3.42,;-.72,-.34,;-4.72,1.97,;-6.19,1.49,;-7.09,2.74,;-6.19,3.98,;-6.96,5.31,;-4.72,3.51,;3.19,.43,;4.09,-.82,;5.56,-.34,;5.56,1.2,;4.09,1.67,;3.7,3.16,;2.21,3.56,;4.78,4.25,;6.27,3.85,;4.39,5.73,;3.72,-1.62,;5.21,-2.02,)|
CCCN(CCOC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:28.31,wD:25.27,(6.27,.41,;5.5,-.92,;3.96,-.92,;3.19,.41,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;.74,-.83,;1.14,-2.32,;2.63,-2.72,;3.03,-4.21,;4.52,-4.61,;5.6,-3.52,;7.09,-3.92,;5.21,-2.03,;3.72,-1.63,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,)|
CC(Nc1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1ccccn1 |r,wU:23.26,wD:20.22,(2.45,3.3,;3.22,1.97,;2.45,.64,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;0,-.61,;.4,-2.1,;1.89,-2.5,;2.28,-3.98,;3.77,-4.38,;4.86,-3.29,;6.35,-3.69,;4.46,-1.81,;2.98,-1.41,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;4.76,1.97,;5.53,.64,;7.07,.64,;7.84,1.97,;7.07,3.3,;5.53,3.3,)|
CCNC(=O)[C@@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.34,wD:27.30,5.4,(5.47,6.28,;4.39,5.19,;4.78,3.7,;3.7,2.61,;2.21,3.01,;4.09,1.13,;5.56,.65,;5.56,-.89,;4.09,-1.37,;3.19,-.12,;1.65,-.12,;.74,1.13,;-.72,.65,;-2.05,1.42,;-3.39,.65,;-3.39,-.89,;-2.05,-1.66,;-2.05,-3.2,;-.72,-3.97,;-.72,-5.51,;-2.05,-6.28,;-3.39,-5.51,;-4.72,-6.28,;-3.39,-3.97,;-.72,-.89,;.74,-1.37,;1.14,-2.85,;2.63,-3.25,;3.03,-4.74,;4.52,-5.14,;5.6,-4.05,;7.09,-4.45,;5.21,-2.56,;3.72,-2.16,;-4.72,1.42,;-6.19,.94,;-7.09,2.19,;-6.19,3.44,;-6.96,4.77,;-4.72,2.96,)|
COC[C@@H]1CC[C@@H](COC)N1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:31.35,6.6,wD:28.31,3.2,(3.88,5.73,;4.28,4.25,;3.19,3.16,;3.59,1.67,;5.06,1.2,;5.06,-.34,;3.59,-.82,;4.93,-1.59,;6.26,-.82,;7.59,-1.59,;2.69,.43,;1.15,.43,;.24,1.67,;-1.22,1.2,;-2.56,1.97,;-3.89,1.2,;-3.89,-.34,;-2.56,-1.11,;-2.56,-2.65,;-1.22,-3.42,;-1.22,-4.96,;-2.56,-5.73,;-3.89,-4.96,;-5.22,-5.73,;-3.89,-3.42,;-1.22,-.34,;.24,-.82,;.64,-2.96,;2.13,-3.36,;2.53,-4.84,;4.01,-5.24,;5.1,-4.15,;6.59,-4.55,;4.7,-2.67,;3.22,-2.27,;-5.22,1.97,;-6.69,1.49,;-7.59,2.74,;-6.69,3.98,;-7.46,5.31,;-5.22,3.51,)|
CO[C@@H]1CCN([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:29.33,6.6,2.1,(7.99,-.45,;6.91,.64,;5.37,.64,;4.6,-.7,;3.06,-.7,;2.29,.64,;3.06,1.97,;2.29,3.3,;4.6,1.97,;.75,.64,;-.16,1.88,;-1.62,1.41,;-2.96,2.18,;-4.29,1.41,;-4.29,-.13,;-2.96,-.9,;-2.96,-2.44,;-1.62,-3.21,;-1.62,-4.75,;-2.96,-5.52,;-4.29,-4.75,;-5.63,-5.52,;-4.29,-3.21,;-1.62,-.13,;-.16,-.61,;.24,-2.1,;1.73,-2.5,;2.82,-1.41,;4.3,-1.81,;4.7,-3.29,;6.19,-3.69,;3.61,-4.38,;2.13,-3.98,;-5.63,2.18,;-7.09,1.7,;-7.99,2.95,;-7.09,4.19,;-7.86,5.52,;-5.63,3.72,)|
CO[C@H]1CCN([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,2.1,wD:29.33,6.6,(7.84,-.7,;7.07,.64,;5.53,.64,;4.76,-.7,;3.22,-.7,;2.45,.64,;3.22,1.97,;2.45,3.3,;4.76,1.97,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;0,-.61,;.4,-2.1,;1.89,-2.5,;2.98,-1.41,;4.46,-1.81,;4.86,-3.29,;6.35,-3.69,;3.77,-4.38,;2.28,-3.98,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,)|
CO[C@@H]1CCN([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:29.33,6.6,2.1,(7.84,-.7,;7.07,.64,;5.53,.64,;4.76,-.7,;3.22,-.7,;2.45,.64,;3.22,1.97,;2.45,3.3,;4.76,1.97,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;0,-.61,;.4,-2.1,;1.89,-2.5,;2.98,-1.41,;4.46,-1.81,;4.86,-3.29,;6.35,-3.69,;3.77,-4.38,;2.28,-3.98,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(=O)N(C)[C@H]3CCC[C@H]23)CC1 |r,wU:4.4,38.41,wD:1.0,34.38,(6.73,-3.69,;5.25,-3.29,;4.85,-1.81,;3.36,-1.41,;2.27,-2.5,;.78,-2.1,;.39,-.61,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,;2.83,.64,;3.6,-.7,;5.14,-.7,;5.91,-2.03,;5.91,.64,;7.45,.64,;5.14,1.97,;5.62,3.43,;4.37,4.34,;3.12,3.43,;3.6,1.97,;2.67,-3.98,;4.16,-4.38,)|
CCC1CN(C)C(=O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:30.34,(1.29,3.3,;2.83,3.3,;3.6,1.97,;5.14,1.97,;5.91,.64,;7.45,.64,;5.14,-.7,;5.91,-2.03,;3.6,-.7,;2.83,.64,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;.39,-.61,;.78,-2.1,;2.27,-2.5,;3.36,-1.41,;4.85,-1.81,;5.25,-3.29,;6.73,-3.69,;4.16,-4.38,;2.67,-3.98,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
CCC1CN(C)C(=O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:30.34,(1.3,3.3,;2.84,3.3,;3.61,1.97,;5.15,1.97,;5.9,.64,;7.44,.63,;5.14,-.68,;5.92,-2.01,;3.61,-.7,;2.84,.64,;1.3,.64,;.4,1.88,;-1.07,1.41,;-2.4,2.18,;-3.73,1.41,;-3.73,-.13,;-2.4,-.9,;-2.4,-2.44,;-1.07,-3.21,;-1.07,-4.75,;-2.4,-5.52,;-3.73,-4.75,;-5.07,-5.52,;-3.73,-3.21,;-1.07,-.13,;.4,-.61,;.8,-2.1,;2.28,-2.5,;3.37,-1.41,;4.86,-1.81,;5.26,-3.29,;6.75,-3.69,;4.17,-4.38,;2.68,-3.98,;-5.07,2.18,;-6.53,1.7,;-7.44,2.95,;-6.53,4.19,;-7.3,5.52,;-5.07,3.72,)|
CCC1CN(C)C(=O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:30.34,(1.3,3.3,;2.84,3.3,;3.61,1.97,;5.15,1.97,;5.9,.64,;7.44,.64,;5.14,-.68,;5.91,-2.02,;3.61,-.7,;2.84,.64,;1.3,.64,;.4,1.88,;-1.07,1.41,;-2.4,2.18,;-3.73,1.41,;-3.73,-.13,;-2.4,-.9,;-2.4,-2.44,;-1.07,-3.21,;-1.07,-4.75,;-2.4,-5.52,;-3.73,-4.75,;-5.07,-5.52,;-3.73,-3.21,;-1.07,-.13,;.4,-.61,;.8,-2.1,;2.28,-2.5,;3.37,-1.41,;4.86,-1.81,;5.26,-3.29,;6.75,-3.69,;4.17,-4.38,;2.68,-3.98,;-5.07,2.18,;-6.53,1.7,;-7.44,2.95,;-6.53,4.19,;-7.3,5.52,;-5.07,3.72,)|
C[C@H]1CCC(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCC3COCCC23)CC1 |r,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.9,-.7,;6.68,.64,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CCC(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CN(CC[C@@H]23)C(=O)OCc2ccccc2)CC1 |r,wU:32.35,wD:37.41,1.0,(3.02,-6.79,;1.69,-6.02,;1.69,-4.48,;.36,-3.71,;-.98,-4.48,;-2.31,-3.71,;-2.31,-2.17,;-1.4,-.92,;-2.31,.32,;-3.77,-.15,;-5.11,.62,;-6.44,-.15,;-6.44,-1.69,;-5.11,-2.46,;-5.11,-4,;-3.77,-4.77,;-3.77,-6.31,;-5.11,-7.08,;-6.44,-6.31,;-7.78,-7.08,;-6.44,-4.77,;-3.77,-1.69,;-7.78,.62,;-9.24,.14,;-10.15,1.39,;-9.24,2.63,;-10.01,3.97,;-7.78,2.16,;.14,-.92,;.91,-2.25,;2.44,-2.25,;3.22,-.92,;2.45,.41,;3.22,1.75,;2.45,3.08,;.91,3.08,;.14,1.75,;.91,.41,;3.22,4.41,;2.45,5.75,;4.76,4.41,;5.53,5.75,;7.07,5.75,;7.84,4.41,;9.38,4.41,;10.15,5.75,;9.38,7.08,;7.84,7.08,;-.98,-6.02,;.36,-6.79,)|
C[C@H]1CCC(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CNCC[C@@H]23)CC1 |r,wU:32.35,wD:37.41,1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.9,-.7,;6.68,.64,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CCC(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CN(Cc4ccccc4)CC[C@@H]23)CC1 |r,wU:32.35,wD:44.49,1.0,(4.18,-6.12,;2.85,-5.35,;2.85,-3.81,;1.51,-3.04,;.18,-3.81,;-1.15,-3.04,;-1.15,-1.5,;-.25,-.25,;-1.15,.99,;-2.62,.52,;-3.95,1.29,;-5.29,.52,;-5.29,-1.02,;-3.95,-1.79,;-3.95,-3.33,;-2.62,-4.1,;-2.62,-5.64,;-3.95,-6.41,;-5.29,-5.64,;-6.62,-6.41,;-5.29,-4.1,;-2.62,-1.02,;-6.62,1.29,;-8.09,.81,;-8.99,2.06,;-8.09,3.3,;-8.86,4.64,;-6.62,2.83,;1.29,-.25,;2.06,-1.59,;3.59,-1.59,;4.37,-.25,;3.6,1.08,;4.37,2.41,;3.6,3.75,;4.37,5.08,;5.91,5.08,;6.68,3.75,;8.22,3.75,;8.99,5.08,;8.22,6.41,;6.68,6.41,;2.06,3.75,;1.29,2.41,;2.06,1.08,;.18,-5.35,;1.51,-6.12,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2C3CCC2C(O)C3)CC1 |r,wU:4.4,wD:1.0,TLB:7:28:33.35:31.30,THB:34:33:31.30:28,(5.56,-5.23,;4.23,-4.46,;4.23,-2.92,;2.89,-2.15,;1.56,-2.92,;.22,-2.15,;.22,-.61,;1.13,.64,;.22,1.88,;-1.24,1.41,;-2.57,2.18,;-3.91,1.41,;-3.91,-.13,;-2.57,-.9,;-2.57,-2.44,;-1.24,-3.21,;-1.24,-4.75,;-2.57,-5.52,;-3.91,-4.75,;-5.24,-5.52,;-3.91,-3.21,;-1.24,-.13,;-5.24,2.18,;-6.71,1.7,;-7.61,2.95,;-6.71,4.19,;-7.48,5.52,;-5.24,3.72,;2.67,.64,;4.2,.82,;3.98,-.7,;4.91,-1.93,;5.12,-.41,;6.07,.8,;7.61,.8,;5.15,2.04,;1.56,-4.46,;2.89,-5.23,)|
CC(C)[C@@H]1C[C@](C)(O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,5.5,wD:30.34,5.6,3.2,(4.09,4.55,;3.32,3.21,;1.78,3.21,;4.09,1.88,;5.56,1.41,;5.56,-.13,;7.1,-.13,;6.33,-1.47,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.06,2.18,;-3.39,1.41,;-3.39,-.13,;-2.06,-.9,;-2.06,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.06,-5.52,;-3.39,-4.75,;-4.73,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;.74,-2.15,;2.07,-2.92,;3.41,-2.15,;4.74,-2.92,;4.74,-4.46,;6.07,-5.23,;3.41,-5.23,;2.07,-4.46,;-4.73,2.18,;-6.19,1.7,;-7.1,2.95,;-6.19,4.19,;-6.96,5.52,;-4.73,3.72,)|
COC[C@@H]1C[C@H](CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)OC |r,wU:25.28,5.43,wD:28.32,3.2,(3.82,5.73,;4.22,4.25,;3.13,3.16,;3.53,1.67,;4.99,1.2,;4.99,-.34,;3.53,-.82,;2.62,.43,;1.08,.43,;.18,1.67,;-1.29,1.2,;-2.62,1.97,;-3.96,1.2,;-3.96,-.34,;-2.62,-1.11,;-2.62,-2.65,;-1.29,-3.42,;-1.29,-4.96,;-2.62,-5.73,;-3.96,-4.96,;-5.29,-5.73,;-3.96,-3.42,;-1.29,-.34,;.18,-.82,;.18,-2.36,;1.51,-3.13,;2.84,-2.36,;4.18,-3.13,;4.18,-4.67,;5.51,-5.44,;2.84,-5.44,;1.51,-4.67,;-5.29,1.97,;-6.75,1.49,;-7.66,2.74,;-6.75,3.98,;-7.52,5.31,;-5.29,3.51,;6.33,-1.11,;7.66,-.34,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(O)CC3CCCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,-2.03,;6.27,.64,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
CO[C@@H]1C[C@H](N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)C1(CC1)OC |r,wU:24.27,2.1,wD:27.31,4.42,(7.66,-.34,;6.33,-1.11,;4.99,-.34,;4.99,1.2,;3.53,1.67,;2.62,.43,;3.53,-.82,;1.08,.43,;.18,1.67,;-1.29,1.2,;-2.62,1.97,;-3.96,1.2,;-3.96,-.34,;-2.62,-1.11,;-2.62,-2.65,;-1.29,-3.42,;-1.29,-4.96,;-2.62,-5.73,;-3.96,-4.96,;-5.29,-5.73,;-3.96,-3.42,;-1.29,-.34,;.18,-.82,;.18,-2.36,;1.51,-3.13,;2.84,-2.36,;4.18,-3.13,;4.18,-4.67,;5.51,-5.44,;2.84,-5.44,;1.51,-4.67,;-5.29,1.97,;-6.75,1.49,;-7.66,2.74,;-6.75,3.98,;-7.52,5.31,;-5.29,3.51,;3.13,3.16,;2.04,4.25,;1.64,2.76,;4.22,4.25,;3.82,5.73,)|
CO[C@@H]1C[C@@H](N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)C1(CC1)OC |r,wU:24.27,4.42,2.1,wD:27.31,(7.66,-.34,;6.33,-1.11,;4.99,-.34,;4.99,1.2,;3.53,1.67,;2.62,.43,;3.53,-.82,;1.08,.43,;.18,1.67,;-1.29,1.2,;-2.62,1.97,;-3.96,1.2,;-3.96,-.34,;-2.62,-1.11,;-2.62,-2.65,;-1.29,-3.42,;-1.29,-4.96,;-2.62,-5.73,;-3.96,-4.96,;-5.29,-5.73,;-3.96,-3.42,;-1.29,-.34,;.18,-.82,;.18,-2.36,;1.51,-3.13,;2.84,-2.36,;4.18,-3.13,;4.18,-4.67,;5.51,-5.44,;2.84,-5.44,;1.51,-4.67,;-5.29,1.97,;-6.75,1.49,;-7.66,2.74,;-6.75,3.98,;-7.52,5.31,;-5.29,3.51,;3.13,3.16,;2.04,4.25,;1.64,2.76,;4.22,4.25,;3.82,5.73,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCSCC2C)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;3.96,1.97,;3.19,3.3,;3.03,-3.98,;4.52,-4.38,)|
CO[C@@H]1C[C@@H](C(F)F)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,2.1,wD:30.34,4.4,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;2.76,3.21,;3.53,4.55,;1.22,3.21,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.58,-2.1,;2.06,-2.5,;3.15,-1.41,;4.64,-1.81,;5.04,-3.29,;6.53,-3.69,;3.95,-4.38,;2.46,-3.98,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
CCO[C@@H]1C[C@@H](CF)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,3.2,wD:30.34,5.5,(8.33,-.9,;6.99,-.13,;5.66,-.9,;4.32,-.13,;4.32,1.41,;2.86,1.88,;2.09,3.21,;2.86,4.55,;1.95,.64,;2.86,-.61,;.41,.64,;-.49,1.88,;-1.95,1.41,;-3.29,2.18,;-4.62,1.41,;-4.62,-.13,;-3.29,-.9,;-3.29,-2.44,;-1.95,-3.21,;-1.95,-4.75,;-3.29,-5.52,;-4.62,-4.75,;-5.96,-5.52,;-4.62,-3.21,;-1.95,-.13,;-.49,-.61,;-.09,-2.1,;1.4,-2.5,;2.48,-1.41,;3.97,-1.81,;4.37,-3.29,;5.86,-3.69,;3.28,-4.38,;1.79,-3.98,;-5.96,2.18,;-7.42,1.7,;-8.33,2.95,;-7.42,4.19,;-8.19,5.52,;-5.96,3.72,)|
CCN1[C@@H]2CCC[C@H]2N(CC1=O)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:29.33,3.3,wD:32.37,7.6,(7.84,1.97,;7.07,.64,;5.53,.64,;4.76,1.97,;5.23,3.43,;3.99,4.34,;2.74,3.43,;3.22,1.97,;2.45,.64,;3.22,-.7,;4.76,-.7,;5.53,-2.03,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;0,-.61,;.4,-2.1,;1.89,-2.5,;2.98,-1.41,;4.46,-1.81,;4.86,-3.29,;6.35,-3.69,;3.77,-4.38,;2.28,-3.98,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,)|
COCCO[C@@H]1C[C@@H](C(C)C)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.33,5.4,wD:33.37,7.7,(9.45,-2.6,;8.36,-1.52,;6.87,-1.91,;5.78,-.83,;4.29,-1.22,;3.2,-.13,;3.2,1.41,;1.74,1.88,;.97,3.21,;-.57,3.21,;1.74,4.55,;.83,.64,;1.74,-.61,;-.71,.64,;-1.61,1.88,;-3.08,1.41,;-4.41,2.18,;-5.74,1.41,;-5.74,-.13,;-4.41,-.9,;-4.41,-2.44,;-3.08,-3.21,;-3.08,-4.75,;-4.41,-5.52,;-5.74,-4.75,;-7.08,-5.52,;-5.74,-3.21,;-3.08,-.13,;-1.61,-.61,;-1.21,-2.1,;.28,-2.5,;1.36,-1.41,;2.85,-1.81,;3.25,-3.29,;4.74,-3.69,;2.16,-4.38,;.67,-3.98,;-7.08,2.18,;-8.54,1.7,;-9.45,2.95,;-8.54,4.19,;-9.31,5.52,;-7.08,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC(F)(F)[C@@H]23)CC1 |r,wU:4.4,32.36,wD:38.42,1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;2.15,4.2,;2.15,2.66,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@@H]3CCC[C@H]3OCC2C)CC1 |r,wU:1.0,33.36,wD:4.4,29.33,(7.18,-4.41,;5.69,-4.02,;4.61,-5.1,;3.12,-4.71,;2.72,-3.22,;1.23,-2.82,;.65,-.61,;1.56,.64,;.65,1.88,;-.81,1.41,;-2.15,2.18,;-3.48,1.41,;-3.48,-.13,;-2.15,-.9,;-2.15,-2.44,;-.81,-3.21,;-.81,-4.75,;-2.15,-5.52,;-3.48,-4.75,;-4.81,-5.52,;-3.48,-3.21,;-.81,-.13,;-4.81,2.18,;-6.28,1.7,;-7.18,2.95,;-6.28,4.19,;-7.05,5.52,;-4.81,3.72,;3.1,.64,;3.87,1.97,;3.39,3.43,;4.64,4.34,;5.88,3.43,;5.41,1.97,;6.18,.64,;5.41,-.7,;3.87,-.7,;3.1,-2.03,;3.81,-2.13,;5.3,-2.53,)|
CC[C@@H]1[C@@H](C)OCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,3.3,wD:29.33,2.1,(3.96,4.64,;3.19,3.3,;3.96,1.97,;5.5,1.97,;6.27,3.3,;6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CC(F)(F)C[C@@H]23)CC1 |r,wU:4.4,32.36,wD:1.0,38.41,(7.09,-3.87,;5.6,-3.47,;5.21,-1.98,;3.72,-1.58,;2.63,-2.67,;1.14,-2.28,;.74,-.79,;1.65,.46,;.74,1.7,;-.72,1.23,;-2.05,2,;-3.39,1.23,;-3.39,-.31,;-2.05,-1.08,;-2.05,-2.62,;-3.39,-3.39,;-3.39,-4.93,;-2.05,-5.7,;-.72,-4.93,;.61,-5.7,;-.72,-3.39,;-.72,-.31,;-4.72,2,;-6.19,1.52,;-7.09,2.77,;-6.19,4.01,;-6.96,5.35,;-4.72,3.54,;3.19,.46,;3.96,-.88,;5.5,-.88,;6.27,.46,;5.5,1.79,;5.97,3.26,;4.73,4.16,;4.73,5.7,;6.06,4.93,;3.48,3.26,;3.96,1.79,;3.03,-4.16,;4.52,-4.56,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccn2)CC1 |r,wU:4.4,wD:1.0,33.38,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;1.65,3.08,;.88,4.41,;1.65,5.75,;3.19,5.75,;3.96,4.41,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC3CCOCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-3.39,-3.21,;-3.39,-4.75,;-2.05,-5.52,;-.72,-4.75,;.61,-5.52,;-.72,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(C)OC3CCOCC23)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,-2.03,;6.68,.64,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC3COCC23)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CC(F)C[C@@H]23)CC1 |r,wU:32.36,4.4,wD:37.40,1.0,(6.49,-5.41,;5.16,-4.64,;5.16,-3.1,;3.82,-2.33,;2.49,-3.1,;1.16,-2.33,;1.16,-.79,;2.06,.46,;1.16,1.7,;-.31,1.23,;-1.64,2,;-2.98,1.23,;-2.98,-.31,;-1.64,-1.08,;-1.64,-2.62,;-2.98,-3.39,;-2.98,-4.93,;-1.64,-5.7,;-.31,-4.93,;1.02,-5.7,;-.31,-3.39,;-.31,-.31,;-4.31,2,;-5.78,1.52,;-6.68,2.77,;-5.78,4.01,;-6.55,5.35,;-4.31,3.54,;3.6,.46,;4.37,-.88,;5.91,-.88,;6.68,.46,;5.91,1.79,;6.39,3.26,;5.14,4.16,;5.14,5.7,;3.89,3.26,;4.37,1.79,;2.49,-4.64,;3.82,-5.41,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCCOC3CCCC23)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-3.39,-3.21,;-3.39,-4.75,;-2.05,-5.52,;-.72,-4.75,;.61,-5.52,;-.72,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.98,-.69,;5.5,-.89,;6.62,.17,;6.48,1.7,;5.19,2.55,;5.19,4.09,;3.73,4.57,;2.82,3.32,;3.73,2.08,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC(C)(C)C2C)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-3.39,-3.21,;-3.39,-4.75,;-2.05,-5.52,;-.72,-4.75,;.61,-5.52,;-.72,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.5,3.51,;6.83,2.74,;3.96,1.97,;3.19,3.3,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(C)OC3CCCCC23)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,-2.03,;6.68,.64,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(NCc3ccccc3)nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)CC1 |r,wU:4.4,wD:1.0,(6.35,-3.69,;4.86,-3.29,;4.46,-1.81,;2.98,-1.41,;1.89,-2.5,;.4,-2.1,;0,-.61,;.91,.64,;2.45,.64,;3.22,1.97,;4.76,1.97,;5.53,.64,;7.07,.64,;7.84,1.97,;7.07,3.3,;5.53,3.3,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-4.13,-3.21,;-4.13,-4.75,;-2.8,-5.52,;-1.46,-4.75,;-.13,-5.52,;-1.46,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.28,-3.98,;3.77,-4.38,)|
COCC(C)Nc1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(7.45,3.3,;5.91,3.3,;5.14,1.97,;3.6,1.97,;2.83,3.3,;2.83,.64,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;.39,-.61,;.78,-2.1,;2.27,-2.5,;3.36,-1.41,;4.85,-1.81,;5.25,-3.29,;6.73,-3.69,;4.16,-4.38,;2.67,-3.98,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N(C)Cc2ccccc2)CC1 |r,wU:4.4,wD:1.0,(6.35,-3.69,;4.86,-3.29,;4.46,-1.81,;2.98,-1.41,;1.89,-2.5,;.4,-2.1,;0,-.61,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.45,.64,;3.22,-.7,;3.22,1.97,;4.76,1.97,;5.53,.64,;7.07,.64,;7.84,1.97,;7.07,3.3,;5.53,3.3,;2.28,-3.98,;3.77,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(C)OC3CCCC23)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,-2.03,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CC(C)O[C@H](C)[C@H]2C)CC1 |r,wU:4.4,33.37,wD:1.0,35.40,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,-2.03,;6.68,.64,;5.91,1.97,;6.68,3.3,;4.37,1.97,;3.6,3.3,;2.49,-4.46,;3.82,-5.23,)|
COCC(C)N(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.26,wD:27.30,(7.45,3.3,;5.91,3.3,;5.14,1.97,;3.6,1.97,;2.83,3.3,;2.83,.64,;3.6,-.7,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-3.75,-3.21,;-3.75,-4.75,;-2.41,-5.52,;-1.08,-4.75,;.25,-5.52,;-1.08,-3.21,;-1.08,-.13,;.39,-.61,;.78,-2.1,;2.27,-2.5,;3.36,-1.41,;4.85,-1.81,;5.25,-3.29,;6.73,-3.69,;4.16,-4.38,;2.67,-3.98,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
C[C@H]1CC[C@H](Cn2c(Nc3ccccn3)nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;3.19,.64,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(Nc3ccccn3)nc3cc(nc(-c4cncc(Cl)c4)c23)C(O)=O)CC1 |r,wU:4.4,wD:1.0,(6.57,-3.25,;5.09,-2.85,;4.69,-1.36,;3.2,-.96,;2.11,-2.05,;.62,-1.65,;.23,-.17,;1.13,1.08,;2.67,1.08,;3.44,2.41,;2.67,3.75,;3.44,5.08,;4.98,5.08,;5.75,3.75,;4.98,2.41,;.23,2.33,;-1.24,1.85,;-2.57,2.62,;-3.91,1.85,;-3.91,.31,;-2.57,-.46,;-2.57,-2,;-1.24,-2.77,;-1.24,-4.31,;-2.57,-5.08,;-3.91,-4.31,;-5.24,-5.08,;-3.91,-2.77,;-1.24,.31,;-5.24,2.62,;-6.57,1.85,;-5.24,4.16,;2.51,-3.54,;4,-3.94,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N(C)c2ccccc2)CC1 |r,wU:1.0,wD:4.4,(6.49,-5.23,;5.16,-4.46,;3.82,-5.23,;2.49,-4.46,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;4.37,1.97,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;3.82,-2.15,;5.16,-2.92,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(O)=O)N(C)c2ccccc2)CC1 |r,wU:1.0,wD:4.4,(5.97,-4.79,;4.64,-4.02,;3.3,-4.79,;1.97,-4.02,;1.97,-2.48,;.64,-1.71,;.64,-.17,;1.54,1.08,;.64,2.33,;-.83,1.85,;-2.16,2.62,;-3.49,1.85,;-3.49,.31,;-2.16,-.46,;-2.16,-2,;-.83,-2.77,;-.83,-4.31,;-2.16,-5.08,;-3.49,-4.31,;-4.83,-5.08,;-3.49,-2.77,;-.83,.31,;-4.83,2.62,;-6.16,1.85,;-4.83,4.16,;3.08,1.08,;3.85,-.25,;3.85,2.41,;5.39,2.41,;6.16,3.75,;5.39,5.08,;3.85,5.08,;3.08,3.75,;3.3,-1.71,;4.64,-2.48,)|
C[C@H]1CC[C@H](Cn2c(Nc3ccccc3)nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)CC1 |r,wU:1.0,wD:4.4,(6.49,-5.23,;5.16,-4.46,;3.82,-5.23,;2.49,-4.46,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;3.6,.64,;4.37,1.97,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.82,-2.15,;5.16,-2.92,)|
CC([C@H]1CC[C@H](C)CC1)n1c(nc2cc(nc(-c3cncc(Cl)c3)c12)-c1noc(=O)[nH]1)N1CCO[C@@H]2CCC[C@@H]12 |r,wU:2.1,35.40,wD:5.5,39.43,(.05,-3.19,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,)|
CC([C@H]1CC[C@H](C)CC1)n1c(nc2cc(nc(-c3cncc(Cl)c3)c12)-c1noc(=O)[nH]1)N1CCOC[C@H]1C |r,wU:2.1,wD:5.5,36.42,(.05,-3.19,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;3.96,1.97,;3.19,3.3,)|
CC([C@H]1CC[C@H](C)CC1)n1c(nc2cc(nc(-c3cncc(Cl)c3)c12)-c1noc(=O)[nH]1)N1CC(=O)N(C)C[C@H]1C |r,wU:2.1,wD:5.5,38.44,(-.31,-3.19,;.78,-2.1,;2.27,-2.5,;3.36,-1.41,;4.85,-1.81,;5.25,-3.29,;6.73,-3.69,;4.16,-4.38,;2.67,-3.98,;.39,-.61,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,;2.83,.64,;3.6,-.7,;5.14,-.7,;5.91,-2.03,;5.91,.64,;7.45,.64,;5.14,1.97,;3.6,1.97,;2.83,3.3,)|
CO[C@@H]1C[C@@H](CF)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,2.1,wD:30.34,4.4,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;3.13,3.37,;4.22,4.46,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.18,-2.15,;-1.36,-2.15,;1.51,-2.92,;2.84,-2.15,;4.18,-2.92,;4.18,-4.46,;5.51,-5.23,;2.84,-5.23,;1.51,-4.46,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
CO[C@@H]1C[C@@H](CF)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,2.1,wD:30.34,4.4,(7.66,-.13,;6.33,-.9,;4.99,-.13,;4.99,1.41,;3.53,1.88,;3.13,3.37,;4.22,4.46,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.18,-2.15,;-.91,-3.24,;1.51,-2.92,;2.84,-2.15,;4.18,-2.92,;4.18,-4.46,;5.51,-5.23,;2.84,-5.23,;1.51,-4.46,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
CC(C)[C@@H]1C[C@@H](O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:5.5,27.30,wD:3.2,30.34,(4.78,4.46,;3.7,3.37,;2.21,3.77,;4.09,1.88,;5.56,1.41,;5.56,-.13,;6.89,-.9,;4.09,-.61,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;.05,-3.19,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CO[C@@H]1C[C@@H](C)N(C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,2.1,wD:4.4,29.33,(7.68,-.44,;6.27,-1.06,;5.02,-.16,;4.99,1.41,;3.53,1.88,;3.13,3.37,;2.62,.64,;3.53,-.61,;1.08,.64,;.18,1.88,;-1.29,1.41,;-2.62,2.18,;-3.96,1.41,;-3.96,-.13,;-2.62,-.9,;-2.62,-2.44,;-1.29,-3.21,;-1.29,-4.75,;-2.62,-5.52,;-3.96,-4.75,;-5.29,-5.52,;-3.96,-3.21,;-1.29,-.13,;.18,-.61,;.58,-2.1,;-.51,-3.19,;2.06,-2.5,;3.15,-1.41,;4.64,-1.81,;5.04,-3.29,;6.53,-3.69,;3.95,-4.38,;2.46,-3.98,;-5.29,2.18,;-6.75,1.7,;-7.66,2.95,;-6.75,4.19,;-7.52,5.52,;-5.29,3.72,)|
CC([C@H]1CC[C@H](C)CC1)n1c(nc2cc(nc(-c3cncc(Cl)c3)c12)-c1noc(=O)[nH]1)N1C[C@H](O)C[C@H]1C |r,wU:33.38,2.1,wD:36.42,5.5,(.05,-3.19,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;6.89,-.9,;5.56,1.41,;4.09,1.88,;3.7,3.37,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN(C[C@H]2C)C(C)=O)CC1 |r,wU:4.4,wD:1.0,33.38,(6.35,-3.69,;4.86,-3.29,;4.46,-1.81,;2.98,-1.41,;1.89,-2.5,;.4,-2.1,;0,-.61,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.45,.64,;3.22,-.7,;4.76,-.7,;5.53,.64,;4.76,1.97,;3.22,1.97,;2.45,3.3,;7.07,.64,;7.84,-.7,;7.84,1.97,;2.28,-3.98,;3.77,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN(C[C@H]2C)C(=O)C2CC2)CC1 |r,wU:4.4,wD:1.0,33.38,(5.68,-3.69,;4.19,-3.29,;3.8,-1.81,;2.31,-1.41,;1.22,-2.5,;-.27,-2.1,;-.67,-.61,;.24,.64,;-.67,1.88,;-2.13,1.41,;-3.47,2.18,;-4.8,1.41,;-4.8,-.13,;-3.47,-.9,;-3.47,-2.44,;-2.13,-3.21,;-2.13,-4.75,;-3.47,-5.52,;-4.8,-4.75,;-6.13,-5.52,;-4.8,-3.21,;-2.13,-.13,;-6.13,2.18,;-7.6,1.7,;-8.5,2.95,;-7.6,4.19,;-8.37,5.52,;-6.13,3.72,;1.78,.64,;2.55,-.7,;4.09,-.7,;4.86,.64,;4.09,1.97,;2.55,1.97,;1.78,3.3,;6.4,.64,;7.17,1.97,;7.17,-.7,;7.17,-2.24,;8.5,-1.47,;1.62,-3.98,;3.11,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2CC2)CC1 |r,wU:4.4,29.33,wD:1.0,34.39,(5.68,-3.69,;4.19,-3.29,;3.8,-1.81,;2.31,-1.41,;1.22,-2.5,;-.27,-2.1,;-.67,-.61,;.24,.64,;-.67,1.88,;-2.13,1.41,;-3.47,2.18,;-4.8,1.41,;-4.8,-.13,;-3.47,-.9,;-3.47,-2.44,;-2.13,-3.21,;-2.13,-4.75,;-3.47,-5.52,;-4.8,-4.75,;-6.13,-5.52,;-4.8,-3.21,;-2.13,-.13,;-6.13,2.18,;-7.6,1.7,;-8.5,2.95,;-7.6,4.19,;-8.37,5.52,;-6.13,3.72,;1.78,.64,;2.55,-.7,;1.21,-1.47,;4.09,-.7,;4.86,.64,;4.09,1.97,;2.55,1.97,;1.78,3.3,;6.4,.64,;7.17,1.97,;7.17,-.7,;7.17,-2.24,;8.5,-1.47,;1.62,-3.98,;3.11,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)S(C)(=O)=O)CC1 |r,wU:1.0,29.33,wD:4.4,34.39,(6.35,-3.69,;4.86,-3.29,;3.77,-4.38,;2.28,-3.98,;1.89,-2.5,;.4,-2.1,;0,-.61,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.45,.64,;3.22,-.7,;1.68,-.7,;4.76,-.7,;5.53,.64,;4.76,1.97,;3.22,1.97,;2.45,3.3,;7.07,.64,;7.84,-.7,;7.84,1.97,;6.3,1.97,;2.98,-1.41,;4.46,-1.81,)|
CCOC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:33.37,7.7,wD:30.33,10.10,(8.99,.64,;8.22,-.7,;6.68,-.7,;5.91,.64,;6.68,1.97,;4.37,.64,;3.6,-.7,;2.06,-.7,;.73,-1.47,;1.29,.64,;2.06,1.97,;1.29,3.3,;3.6,1.97,;-.25,.64,;-1.15,1.88,;-2.62,1.41,;-3.95,2.18,;-5.29,1.41,;-5.29,-.13,;-3.95,-.9,;-3.95,-2.44,;-2.62,-3.21,;-2.62,-4.75,;-3.95,-5.52,;-5.29,-4.75,;-6.62,-5.52,;-5.29,-3.21,;-2.62,-.13,;-1.15,-.61,;-.76,-2.1,;.73,-2.5,;1.13,-3.98,;2.62,-4.38,;3.71,-3.29,;5.19,-3.69,;3.31,-1.81,;1.82,-1.41,;-6.62,2.18,;-8.09,1.7,;-8.99,2.95,;-8.09,4.19,;-8.86,5.52,;-6.62,3.72,)|
CCNC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:7.7,33.37,wD:10.10,30.33,(9.17,-.7,;7.84,.07,;6.5,-.7,;5.73,.64,;6.5,1.97,;4.19,.64,;3.42,-.7,;1.88,-.7,;.55,-1.47,;1.11,.64,;1.88,1.97,;1.11,3.3,;3.42,1.97,;-.43,.64,;-1.33,1.88,;-2.8,1.41,;-4.13,2.18,;-5.47,1.41,;-5.47,-.13,;-4.13,-.9,;-4.13,-2.44,;-2.8,-3.21,;-2.8,-4.75,;-4.13,-5.52,;-5.47,-4.75,;-6.8,-5.52,;-5.47,-3.21,;-2.8,-.13,;-1.33,-.61,;-1.33,-2.15,;.04,-2.85,;.04,-4.39,;1.37,-5.16,;2.71,-4.39,;4.04,-5.16,;2.71,-2.85,;1.37,-2.08,;-6.8,2.18,;-8.26,1.7,;-9.17,2.95,;-8.26,4.19,;-9.03,5.52,;-6.8,3.72,)|
CCC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:32.36,6.6,wD:29.32,9.9,(7.07,3.3,;7.84,1.97,;7.07,.64,;7.84,-.7,;5.53,.64,;4.76,-.7,;3.22,-.7,;1.88,-1.47,;2.45,.64,;3.22,1.97,;2.45,3.3,;4.76,1.97,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;0,-.61,;.4,-2.1,;1.89,-2.5,;2.28,-3.98,;3.77,-4.38,;4.86,-3.29,;6.35,-3.69,;4.46,-1.81,;2.98,-1.41,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2CCC2)CC1 |r,wU:1.0,34.39,wD:4.4,29.33,(5.61,-3.69,;4.12,-3.29,;3.03,-4.38,;1.54,-3.98,;1.14,-2.5,;-.34,-2.1,;-.74,-.61,;.16,.64,;-.74,1.88,;-2.21,1.41,;-3.54,2.18,;-4.88,1.41,;-4.88,-.13,;-3.54,-.9,;-3.54,-2.44,;-2.21,-3.21,;-2.21,-4.75,;-3.54,-5.52,;-4.88,-4.75,;-6.21,-5.52,;-4.88,-3.21,;-2.21,-.13,;-6.21,2.18,;-7.67,1.7,;-8.58,2.95,;-7.67,4.19,;-8.44,5.52,;-6.21,3.72,;1.7,.64,;2.47,1.97,;1.7,3.3,;4.01,1.97,;4.78,.64,;4.01,-.7,;2.47,-.7,;.93,-.7,;6.32,.64,;7.09,-.7,;7.09,1.97,;8.58,2.37,;8.18,3.86,;6.69,3.46,;2.23,-1.41,;3.72,-1.81,)|
CCCC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:33.37,10.10,wD:30.33,7.7,(8.99,.64,;8.22,1.97,;6.68,1.97,;5.91,.64,;6.68,-.7,;4.37,.64,;3.6,1.97,;2.06,1.97,;1.29,3.3,;1.29,.64,;2.06,-.7,;.52,-.7,;3.6,-.7,;-.25,.64,;-1.15,1.88,;-2.62,1.41,;-3.95,2.18,;-5.29,1.41,;-5.29,-.13,;-3.95,-.9,;-3.95,-2.44,;-2.62,-3.21,;-2.62,-4.75,;-3.95,-5.52,;-5.29,-4.75,;-6.62,-5.52,;-5.29,-3.21,;-2.62,-.13,;-1.15,-.61,;-.76,-2.1,;.73,-2.5,;1.13,-3.98,;2.62,-4.38,;3.71,-3.29,;5.19,-3.69,;3.31,-1.81,;1.82,-1.41,;-6.62,2.18,;-8.09,1.7,;-8.99,2.95,;-8.09,4.19,;-8.86,5.52,;-6.62,3.72,)|
COC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:32.36,9.9,wD:29.32,6.6,(8.61,-.7,;7.07,-.7,;6.3,.64,;7.07,1.97,;4.76,.64,;3.99,1.97,;2.45,1.97,;1.68,3.3,;1.68,.64,;2.45,-.7,;.96,-1.1,;3.99,-.7,;.14,.64,;-.77,1.88,;-2.23,1.41,;-3.57,2.18,;-4.9,1.41,;-4.9,-.13,;-3.57,-.9,;-3.57,-2.44,;-2.23,-3.21,;-2.23,-4.75,;-3.57,-5.52,;-4.9,-4.75,;-6.24,-5.52,;-4.9,-3.21,;-2.23,-.13,;-.77,-.61,;-.37,-2.1,;1.12,-2.5,;1.51,-3.98,;3,-4.38,;4.09,-3.29,;5.58,-3.69,;3.69,-1.81,;2.21,-1.41,;-6.24,2.18,;-7.7,1.7,;-8.61,2.95,;-7.7,4.19,;-8.47,5.52,;-6.24,3.72,)|
CC(C)OC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:34.38,11.11,wD:31.34,8.8,(8.99,-2.03,;8.22,-.7,;8.99,.64,;6.68,-.7,;5.91,.64,;6.68,1.97,;4.37,.64,;3.6,1.97,;2.06,1.97,;1.29,3.3,;1.29,.64,;2.06,-.7,;.73,-1.47,;3.6,-.7,;-.25,.64,;-1.15,1.88,;-2.62,1.41,;-3.95,2.18,;-5.29,1.41,;-5.29,-.13,;-3.95,-.9,;-3.95,-2.44,;-2.62,-3.21,;-2.62,-4.75,;-3.95,-5.52,;-5.29,-4.75,;-6.62,-5.52,;-5.29,-3.21,;-2.62,-.13,;-1.15,-.61,;-.76,-2.1,;.73,-2.5,;1.13,-3.98,;2.62,-4.38,;3.71,-3.29,;5.19,-3.69,;3.31,-1.81,;1.82,-1.41,;-6.62,2.18,;-8.09,1.7,;-8.99,2.95,;-8.09,4.19,;-8.86,5.52,;-6.62,3.72,)|
CCCNC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:34.38,11.11,wD:31.34,8.8,(9.87,-.99,;8.38,-1.39,;7.29,-.3,;5.8,-.7,;5.03,.64,;5.8,1.97,;3.49,.64,;2.72,1.97,;1.18,1.97,;.41,3.3,;.41,.64,;1.18,-.7,;-.3,-1.1,;2.72,-.7,;-1.13,.64,;-2.03,1.88,;-3.5,1.41,;-4.83,2.18,;-6.16,1.41,;-6.16,-.13,;-4.83,-.9,;-4.83,-2.44,;-3.5,-3.21,;-3.5,-4.75,;-4.83,-5.52,;-6.16,-4.75,;-7.5,-5.52,;-6.16,-3.21,;-3.5,-.13,;-2.03,-.61,;-1.63,-2.1,;-.15,-2.5,;.25,-3.98,;1.74,-4.38,;2.83,-3.29,;4.32,-3.69,;2.43,-1.81,;.94,-1.41,;-7.5,2.18,;-8.96,1.7,;-9.87,2.95,;-8.96,4.19,;-9.73,5.52,;-7.5,3.72,)|
CC(C)NC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:34.38,11.11,wD:31.34,8.8,(9.12,-1.39,;8.03,-.3,;8.43,1.19,;6.55,-.7,;5.78,.64,;6.55,1.97,;4.24,.64,;3.47,1.97,;1.93,1.97,;1.16,3.3,;1.16,.64,;1.93,-.7,;.44,-1.1,;3.47,-.7,;-.38,.64,;-1.29,1.88,;-2.75,1.41,;-4.09,2.18,;-5.42,1.41,;-5.42,-.13,;-4.09,-.9,;-4.09,-2.44,;-2.75,-3.21,;-2.75,-4.75,;-4.09,-5.52,;-5.42,-4.75,;-6.75,-5.52,;-5.42,-3.21,;-2.75,-.13,;-1.29,-.61,;-.89,-2.1,;.6,-2.5,;1,-3.98,;2.48,-4.38,;3.57,-3.29,;5.06,-3.69,;3.17,-1.81,;1.69,-1.41,;-6.75,2.18,;-8.22,1.7,;-9.12,2.95,;-8.22,4.19,;-8.99,5.52,;-6.75,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN(C(C)C2C)C(C)=O)CC1 |r,wU:4.4,wD:1.0,(6.35,-3.69,;4.86,-3.29,;4.46,-1.81,;2.98,-1.41,;1.89,-2.5,;.4,-2.1,;0,-.61,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.45,.64,;3.22,-.7,;4.76,-.7,;5.53,.64,;4.76,1.97,;5.53,3.3,;3.22,1.97,;2.45,3.3,;7.07,.64,;7.84,-.7,;7.84,1.97,;2.28,-3.98,;3.77,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN(C(C)C2C)C(=O)C2CC2)CC1 |r,wU:4.4,wD:1.0,(5.68,-3.69,;4.19,-3.29,;3.8,-1.81,;2.31,-1.41,;1.22,-2.5,;-.27,-2.1,;-.67,-.61,;.24,.64,;-.67,1.88,;-2.13,1.41,;-3.47,2.18,;-4.8,1.41,;-4.8,-.13,;-3.47,-.9,;-3.47,-2.44,;-2.13,-3.21,;-2.13,-4.75,;-3.47,-5.52,;-4.8,-4.75,;-6.13,-5.52,;-4.8,-3.21,;-2.13,-.13,;-6.13,2.18,;-7.6,1.7,;-8.5,2.95,;-7.6,4.19,;-8.37,5.52,;-6.13,3.72,;1.78,.64,;2.55,-.7,;4.09,-.7,;4.86,.64,;4.09,1.97,;4.86,3.3,;2.55,1.97,;1.78,3.3,;6.4,.64,;7.17,1.97,;7.17,-.7,;7.17,-2.24,;8.5,-1.47,;1.62,-3.98,;3.11,-4.38,)|
CC(C)C(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:10.10,30.33,wD:7.7,33.37,(6.3,-2.03,;7.07,-.7,;8.61,-.7,;6.3,.64,;7.07,1.97,;4.76,.64,;3.99,1.97,;2.45,1.97,;1.68,3.3,;1.68,.64,;2.45,-.7,;1.68,-2.03,;3.99,-.7,;.14,.64,;-.77,1.88,;-2.23,1.41,;-3.57,2.18,;-4.9,1.41,;-4.9,-.13,;-3.57,-.9,;-3.57,-2.44,;-2.23,-3.21,;-2.23,-4.75,;-3.57,-5.52,;-4.9,-4.75,;-6.24,-5.52,;-4.9,-3.21,;-2.23,-.13,;-.77,-.61,;-.37,-2.78,;1.12,-3.18,;2.21,-2.09,;3.69,-2.49,;4.09,-3.98,;5.58,-4.38,;3,-5.07,;1.51,-4.67,;-6.24,2.18,;-7.7,1.7,;-8.61,2.95,;-7.7,4.19,;-8.47,5.52,;-6.24,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN([C@@H]3CCC[C@@H]23)C(=O)C2CC2)CC1 |r,wU:4.4,32.36,wD:1.0,36.39,(5.68,-3.69,;4.19,-3.29,;3.8,-1.81,;2.31,-1.41,;1.22,-2.5,;-.27,-2.1,;-.67,-.61,;.24,.64,;-.67,1.88,;-2.13,1.41,;-3.47,2.18,;-4.8,1.41,;-4.8,-.13,;-3.47,-.9,;-3.47,-2.44,;-2.13,-3.21,;-2.13,-4.75,;-3.47,-5.52,;-4.8,-4.75,;-6.13,-5.52,;-4.8,-3.21,;-2.13,-.13,;-6.13,2.18,;-7.6,1.7,;-8.5,2.95,;-7.6,4.19,;-8.37,5.52,;-6.13,3.72,;1.78,.64,;2.55,-.7,;4.09,-.7,;4.86,.64,;4.09,1.97,;4.56,3.43,;3.32,4.34,;2.07,3.43,;2.55,1.97,;6.4,.64,;7.17,1.97,;7.17,-.7,;7.17,-2.24,;8.5,-1.47,;1.62,-3.98,;3.11,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN([C@@H]3CCC[C@@H]23)C(C)=O)CC1 |r,wU:4.4,32.36,wD:1.0,36.39,(6.35,-3.69,;4.86,-3.29,;4.46,-1.81,;2.98,-1.41,;1.89,-2.5,;.4,-2.1,;0,-.61,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.45,.64,;3.22,-.7,;4.76,-.7,;5.53,.64,;4.76,1.97,;5.23,3.43,;3.99,4.34,;2.74,3.43,;3.22,1.97,;7.07,.64,;7.84,-.7,;7.84,1.97,;2.28,-3.98,;3.77,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN([C@@H]3CCC[C@@H]23)C(=O)C(F)F)CC1 |r,wU:4.4,32.36,wD:1.0,36.39,(6.32,-3.1,;4.84,-2.7,;4.44,-1.21,;2.95,-.81,;1.86,-1.9,;.37,-1.51,;-.03,-.02,;.88,1.23,;-.03,2.47,;-1.49,2,;-2.82,2.77,;-4.16,2,;-4.16,.46,;-2.82,-.31,;-2.82,-1.85,;-1.49,-2.62,;-1.49,-4.16,;-2.82,-4.93,;-4.16,-4.16,;-5.49,-4.93,;-4.16,-2.62,;-1.49,.46,;-5.49,2.77,;-5.49,4.31,;-6.96,4.78,;-7.86,3.54,;-9.35,3.14,;-6.96,2.29,;2.42,1.23,;3.19,-.11,;4.73,-.11,;5.5,1.23,;4.73,2.56,;5.21,4.03,;3.96,4.93,;2.71,4.03,;3.19,2.56,;7.04,1.23,;7.81,-.11,;7.81,2.56,;7.04,3.9,;9.35,2.56,;2.26,-3.39,;3.75,-3.79,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCN([C@@H]3CCC[C@@H]23)C(=O)C2CCC2)CC1 |r,wU:4.4,32.36,wD:1.0,36.39,(5.61,-3.69,;4.12,-3.29,;3.72,-1.81,;2.23,-1.41,;1.14,-2.5,;-.34,-2.1,;-.74,-.61,;.16,.64,;-.74,1.88,;-2.21,1.41,;-3.54,2.18,;-4.88,1.41,;-4.88,-.13,;-3.54,-.9,;-3.54,-2.44,;-2.21,-3.21,;-2.21,-4.75,;-3.54,-5.52,;-4.88,-4.75,;-6.21,-5.52,;-4.88,-3.21,;-2.21,-.13,;-6.21,2.18,;-7.67,1.7,;-8.58,2.95,;-7.67,4.19,;-8.44,5.52,;-6.21,3.72,;1.7,.64,;2.47,-.7,;4.01,-.7,;4.78,.64,;4.01,1.97,;4.49,3.43,;3.24,4.34,;2,3.43,;2.47,1.97,;6.32,.64,;7.09,1.97,;7.09,-.7,;6.69,-2.19,;8.18,-2.58,;8.58,-1.1,;1.54,-3.98,;3.03,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)N(C)C)CC1 |r,wU:4.4,29.33,wD:1.0,34.39,(5.58,-4.38,;4.09,-3.98,;3.69,-2.49,;2.21,-2.09,;1.12,-3.18,;-.37,-2.78,;-.77,-.61,;.14,.64,;-.77,1.88,;-2.23,1.41,;-3.57,2.18,;-4.9,1.41,;-4.9,-.13,;-3.57,-.9,;-3.57,-2.44,;-2.23,-3.21,;-2.23,-4.75,;-3.57,-5.52,;-4.9,-4.75,;-6.24,-5.52,;-4.9,-3.21,;-2.23,-.13,;-6.24,2.18,;-7.7,1.7,;-8.61,2.95,;-7.7,4.19,;-8.47,5.52,;-6.24,3.72,;1.68,.64,;2.45,-.7,;1.68,-2.03,;3.99,-.7,;4.76,.64,;3.99,1.97,;2.45,1.97,;1.68,3.3,;6.3,.64,;7.07,1.97,;7.07,-.7,;8.61,-.7,;7.07,-2.24,;1.51,-4.67,;3,-5.07,)|
CCN(C)C(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:8.8,31.34,wD:11.11,34.38,(8.99,-2.03,;8.22,-.7,;6.68,-.7,;6.68,-2.24,;5.91,.64,;6.68,1.97,;4.37,.64,;3.6,-.7,;2.06,-.7,;1.29,-2.03,;1.29,.64,;2.06,1.97,;1.29,3.3,;3.6,1.97,;-.25,.64,;-1.15,1.88,;-2.62,1.41,;-3.95,2.18,;-5.29,1.41,;-5.29,-.13,;-3.95,-.9,;-3.95,-2.44,;-2.62,-3.21,;-2.62,-4.75,;-3.95,-5.52,;-5.29,-4.75,;-6.62,-5.52,;-5.29,-3.21,;-2.62,-.13,;-1.15,-.61,;-.76,-2.78,;.73,-3.18,;1.82,-2.09,;3.31,-2.49,;3.71,-3.98,;5.19,-4.38,;2.62,-5.07,;1.13,-4.67,;-6.62,2.18,;-8.09,1.7,;-8.99,2.95,;-8.09,4.19,;-8.86,5.52,;-6.62,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2(F)CC2)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(5.68,-3.69,;4.19,-3.29,;3.8,-1.81,;2.31,-1.41,;1.22,-2.5,;-.27,-2.1,;-.67,-.61,;.24,.64,;-.67,1.88,;-2.13,1.41,;-3.47,2.18,;-4.8,1.41,;-4.8,-.13,;-3.47,-.9,;-3.47,-2.44,;-2.13,-3.21,;-2.13,-4.75,;-3.47,-5.52,;-4.8,-4.75,;-6.13,-5.52,;-4.8,-3.21,;-2.13,-.13,;-6.13,2.18,;-7.6,1.7,;-8.5,2.95,;-7.6,4.19,;-8.37,5.52,;-6.13,3.72,;1.78,.64,;2.55,1.97,;1.78,3.3,;4.09,1.97,;4.86,.64,;4.09,-.7,;2.55,-.7,;1.46,-1.79,;6.4,.64,;7.17,1.97,;7.17,-.7,;8.26,.39,;7.17,-2.24,;8.5,-1.47,;1.62,-3.98,;3.11,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2CC2(F)F)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(5.02,-3.69,;3.53,-3.29,;3.13,-1.81,;1.64,-1.41,;.55,-2.5,;-.94,-2.1,;-1.33,-.61,;-.43,.64,;-1.33,1.88,;-2.8,1.41,;-4.13,2.18,;-5.47,1.41,;-5.47,-.13,;-4.13,-.9,;-4.13,-2.44,;-2.8,-3.21,;-2.8,-4.75,;-4.13,-5.52,;-5.47,-4.75,;-6.8,-5.52,;-5.47,-3.21,;-2.8,-.13,;-6.8,2.18,;-8.26,1.7,;-9.17,2.95,;-8.26,4.19,;-9.03,5.52,;-6.8,3.72,;1.11,.64,;1.88,1.97,;1.11,3.3,;3.42,1.97,;4.19,.64,;3.42,-.7,;1.88,-.7,;.79,-1.79,;5.73,.64,;6.5,1.97,;6.5,-.7,;6.5,-2.24,;7.84,-1.47,;9.17,-.7,;9.17,-2.24,;.95,-3.98,;2.44,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C(F)F)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(5.58,-3.69,;4.09,-3.29,;3.69,-1.81,;2.21,-1.41,;1.12,-2.5,;-.37,-2.1,;-.77,-.61,;.14,.64,;-.77,1.88,;-2.23,1.41,;-3.57,2.18,;-4.9,1.41,;-4.9,-.13,;-3.57,-.9,;-3.57,-2.44,;-2.23,-3.21,;-2.23,-4.75,;-3.57,-5.52,;-4.9,-4.75,;-6.24,-5.52,;-4.9,-3.21,;-2.23,-.13,;-6.24,2.18,;-7.7,1.7,;-8.61,2.95,;-7.7,4.19,;-8.47,5.52,;-6.24,3.72,;1.68,.64,;2.45,1.97,;1.68,3.3,;3.99,1.97,;4.76,.64,;3.99,-.7,;2.45,-.7,;1.36,-1.79,;6.3,.64,;7.07,1.97,;7.07,-.7,;6.3,-2.03,;8.61,-.7,;1.51,-3.98,;3,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2(C)COC2)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(5.61,-3.69,;4.12,-3.29,;3.72,-1.81,;2.23,-1.41,;1.14,-2.5,;-.34,-2.1,;-.74,-.61,;.16,.64,;-.74,1.88,;-2.21,1.41,;-3.54,2.18,;-4.88,1.41,;-4.88,-.13,;-3.54,-.9,;-3.54,-2.44,;-2.21,-3.21,;-2.21,-4.75,;-3.54,-5.52,;-4.88,-4.75,;-6.21,-5.52,;-4.88,-3.21,;-2.21,-.13,;-6.21,2.18,;-7.67,1.7,;-8.58,2.95,;-7.67,4.19,;-8.44,5.52,;-6.21,3.72,;1.7,.64,;2.47,1.97,;1.7,3.3,;4.01,1.97,;4.78,.64,;4.01,-.7,;2.47,-.7,;1.38,-1.79,;6.32,.64,;7.09,1.97,;7.09,-.7,;8.03,.52,;6.69,-2.19,;8.18,-2.58,;8.58,-1.1,;1.54,-3.98,;3.03,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2(C)CC2)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(5.8,-3.69,;4.32,-3.29,;3.92,-1.81,;2.43,-1.41,;1.34,-2.5,;-.15,-2.1,;-.54,-.61,;.36,.64,;-.54,1.88,;-2.01,1.41,;-3.34,2.18,;-4.68,1.41,;-4.68,-.13,;-3.34,-.9,;-3.34,-2.44,;-2.01,-3.21,;-2.01,-4.75,;-3.34,-5.52,;-4.68,-4.75,;-6.01,-5.52,;-4.68,-3.21,;-2.01,-.13,;-6.01,2.18,;-7.47,1.7,;-8.38,2.95,;-7.47,4.19,;-8.24,5.52,;-6.01,3.72,;1.9,.64,;2.67,1.97,;1.9,3.3,;4.21,1.97,;4.98,.64,;4.21,-.7,;2.67,-.7,;1.58,-1.79,;6.52,.64,;7.29,1.97,;7.29,-.7,;8.38,.39,;6.35,-1.92,;7.88,-2.12,;1.74,-3.98,;3.23,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(=O)C2COC2)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(5.61,-3.69,;4.12,-3.29,;3.72,-1.81,;2.23,-1.41,;1.14,-2.5,;-.34,-2.1,;-.74,-.61,;.16,.64,;-.74,1.88,;-2.21,1.41,;-3.54,2.18,;-4.88,1.41,;-4.88,-.13,;-3.54,-.9,;-3.54,-2.44,;-2.21,-3.21,;-2.21,-4.75,;-3.54,-5.52,;-4.88,-4.75,;-6.21,-5.52,;-4.88,-3.21,;-2.21,-.13,;-6.21,2.18,;-7.67,1.7,;-8.58,2.95,;-7.67,4.19,;-8.44,5.52,;-6.21,3.72,;1.7,.64,;2.47,1.97,;1.7,3.3,;4.01,1.97,;4.78,.64,;4.01,-.7,;2.47,-.7,;1.38,-1.79,;6.32,.64,;7.09,1.97,;7.09,-.7,;6.69,-2.19,;8.18,-2.58,;8.58,-1.1,;1.54,-3.98,;3.03,-4.38,)|
COCC(=O)N1C[C@@H](C)N([C@H](C)C1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:33.37,10.10,wD:30.33,7.7,(8.99,.64,;8.22,-.7,;6.68,-.7,;5.91,.64,;6.68,1.97,;4.37,.64,;3.6,1.97,;2.06,1.97,;1.29,3.3,;1.29,.64,;2.06,-.7,;.73,-1.47,;3.6,-.7,;-.25,.64,;-1.15,1.88,;-2.62,1.41,;-3.95,2.18,;-5.29,1.41,;-5.29,-.13,;-3.95,-.9,;-3.95,-2.44,;-2.62,-3.21,;-2.62,-4.75,;-3.95,-5.52,;-5.29,-4.75,;-6.62,-5.52,;-5.29,-3.21,;-2.62,-.13,;-1.15,-.61,;-.76,-2.1,;.73,-2.5,;1.13,-3.98,;2.62,-4.38,;3.71,-3.29,;5.19,-3.69,;3.31,-1.81,;1.82,-1.41,;-6.62,2.18,;-8.09,1.7,;-8.99,2.95,;-8.09,4.19,;-8.86,5.52,;-6.62,3.72,)|
CCOC(C1CCCC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:29.33,(5.29,6.16,;4.52,4.83,;5.29,3.49,;4.52,2.16,;5.29,.83,;4.81,-.64,;6.06,-1.54,;7.3,-.64,;6.83,.83,;2.98,2.16,;2.07,3.41,;.61,2.93,;-.73,3.7,;-2.06,2.93,;-2.06,1.39,;-.73,.62,;-.73,-.92,;.61,-1.69,;.61,-3.23,;-.73,-4,;-2.06,-3.23,;-3.39,-4,;-2.06,-1.69,;.61,1.39,;2.07,.91,;3.61,-.21,;3.21,-1.7,;4.3,-2.79,;3.9,-4.27,;2.42,-4.67,;2.02,-6.16,;1.33,-3.58,;1.73,-2.1,;-3.39,3.7,;-3.39,5.24,;-4.86,5.72,;-5.76,4.47,;-7.3,4.47,;-4.86,3.22,)|
CCOC(C1CCCC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1n[nH]c(=O)o1 |r,wU:26.29,wD:29.33,(5.29,6.16,;4.52,4.83,;5.29,3.49,;4.52,2.16,;5.29,.83,;4.81,-.64,;6.06,-1.54,;7.3,-.64,;6.83,.83,;2.98,2.16,;2.07,3.41,;.61,2.93,;-.73,3.7,;-2.06,2.93,;-2.06,1.39,;-.73,.62,;-.73,-.92,;.61,-1.69,;.61,-3.23,;-.73,-4,;-2.06,-3.23,;-3.39,-4,;-2.06,-1.69,;.61,1.39,;2.07,.91,;3.61,-.21,;3.21,-1.7,;4.3,-2.79,;3.9,-4.27,;2.42,-4.67,;2.02,-6.16,;1.33,-3.58,;1.73,-2.1,;-3.39,3.7,;-3.39,5.24,;-4.86,5.72,;-5.76,4.47,;-7.3,4.47,;-4.86,3.22,)|
CCOC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.28,wD:22.24,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;2.49,-4.46,;3.82,-5.23,;5.16,-4.46,;6.49,-5.23,;5.16,-2.92,;3.82,-2.15,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CCOC(CC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:23.25,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;5.91,1.97,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;2.49,-4.46,;3.82,-5.23,;5.16,-4.46,;6.49,-5.23,;5.16,-2.92,;3.82,-2.15,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CCC(OCC(F)(F)F)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:29.32,wD:26.28,(5.24,1.97,;3.7,1.97,;2.93,.64,;3.7,-.7,;5.24,-.7,;6.01,.64,;7.35,-.13,;4.68,1.41,;6.78,1.97,;1.39,.64,;.49,1.88,;-.98,1.41,;-2.31,2.18,;-3.64,1.41,;-3.64,-.13,;-2.31,-.9,;-2.31,-2.44,;-.98,-3.21,;-.98,-4.75,;-2.31,-5.52,;-3.64,-4.75,;-4.98,-5.52,;-3.64,-3.21,;-.98,-.13,;.49,-.61,;.49,-2.15,;1.82,-2.92,;1.82,-4.46,;3.16,-5.23,;4.49,-4.46,;5.82,-5.23,;4.49,-2.92,;3.16,-2.15,;-4.98,2.18,;-6.44,1.7,;-7.35,2.95,;-6.44,4.19,;-7.21,5.52,;-4.98,3.72,)|
CCCOC(CC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:24.26,(7.45,-2.03,;5.91,-2.03,;5.14,-.7,;3.6,-.7,;2.83,.64,;3.6,1.97,;5.14,1.97,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;.39,-.61,;.39,-2.15,;1.72,-2.92,;1.72,-4.46,;3.05,-5.23,;4.39,-4.46,;5.72,-5.23,;4.39,-2.92,;3.05,-2.15,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
CCOC(CO)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:23.25,(6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;3.19,3.3,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCOC(COC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.30,wD:24.26,(6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;5.5,1.97,;6.27,3.3,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCOC(C1CC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:27.31,wD:24.27,(6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;5.29,2.74,;3.96,3.51,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCOC(C1CCOCC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.34,wD:27.30,(6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
COCCOC(C1CC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,wD:29.33,(8.61,-2.7,;7.84,-1.37,;6.3,-1.37,;5.53,-.03,;3.99,-.03,;3.22,1.3,;3.99,2.64,;5.32,3.41,;3.99,4.18,;1.68,1.3,;.77,2.55,;-.69,2.07,;-2.03,2.84,;-3.36,2.07,;-3.36,.53,;-2.03,-.24,;-2.03,-1.78,;-.69,-2.55,;-.69,-4.09,;-2.03,-4.86,;-3.36,-4.09,;-4.7,-4.86,;-3.36,-2.55,;-.69,.53,;.77,.06,;1.17,-1.43,;2.66,-1.83,;3.75,-.74,;5.23,-1.14,;5.63,-2.63,;7.12,-3.03,;4.54,-3.72,;3.05,-3.32,;-4.7,2.84,;-4.7,4.38,;-6.16,4.86,;-7.07,3.61,;-8.61,3.61,;-6.16,2.37,)|
CCOC(c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1ccccc1 |r,wU:21.23,wD:24.27,(3.76,6.68,;3.36,5.2,;4.45,4.11,;4.05,2.62,;2.56,2.22,;1.66,3.47,;.19,2.99,;-1.14,3.76,;-2.47,2.99,;-2.47,1.45,;-1.14,.68,;-1.14,-.86,;.19,-1.63,;.19,-3.17,;-1.14,-3.94,;-2.47,-3.17,;-3.81,-3.94,;-2.47,-1.63,;.19,1.45,;1.66,.98,;3.37,-.73,;2.97,-2.22,;4.06,-3.31,;3.66,-4.8,;2.17,-5.2,;1.78,-6.68,;1.09,-4.11,;1.48,-2.62,;-3.81,3.76,;-3.81,5.3,;-5.27,5.78,;-6.18,4.53,;-7.72,4.53,;-5.27,3.29,;5.14,1.53,;4.74,.04,;5.83,-1.04,;7.32,-.65,;7.72,.84,;6.63,1.93,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(O)c2ccc(F)cc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;3.96,1.75,;3.19,3.08,;3.96,4.41,;5.5,4.41,;6.27,5.75,;6.27,3.08,;5.5,1.75,;6.27,.41,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(O)c2ccccc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;6.27,.64,;3.03,-3.98,;4.52,-4.38,)|
COCC(O)(c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1ccccc1 |r,wU:25.28,wD:22.24,(3.76,6.68,;3.36,5.2,;4.45,4.11,;4.05,2.62,;3.65,1.13,;2.56,2.22,;1.66,3.47,;.19,2.99,;-1.14,3.76,;-2.47,2.99,;-2.47,1.45,;-1.14,.68,;-1.14,-.86,;.19,-1.63,;.19,-3.17,;-1.14,-3.94,;-2.47,-3.17,;-3.81,-3.94,;-2.47,-1.63,;.19,1.45,;1.66,.98,;3.37,-.73,;2.97,-2.22,;1.48,-2.62,;1.09,-4.11,;2.17,-5.2,;1.78,-6.68,;3.66,-4.8,;4.06,-3.31,;-3.81,3.76,;-3.81,5.3,;-5.27,5.78,;-6.18,4.53,;-7.72,4.53,;-5.27,3.29,;5.14,1.53,;4.74,.04,;5.83,-1.04,;7.32,-.65,;7.72,.84,;6.63,1.93,)|
CCOC(c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1ccccn1 |r,wU:24.27,wD:21.23,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;2.49,-4.46,;3.82,-5.23,;5.16,-4.46,;6.49,-5.23,;5.16,-2.92,;3.82,-2.15,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;4.37,1.97,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,)|
CCOC(c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1cccnc1 |r,wU:24.27,wD:21.23,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;2.49,-4.46,;3.82,-5.23,;5.16,-4.46,;6.49,-5.23,;5.16,-2.92,;3.82,-2.15,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;4.37,1.97,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,)|
CCOC(c1cscn1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:29.33,wD:26.29,(6.27,.64,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;3.48,3.43,;4.73,4.34,;5.97,3.43,;5.5,1.97,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.03,-3.98,;4.52,-4.38,;5.6,-3.29,;7.09,-3.69,;5.21,-1.81,;3.72,-1.41,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCOC(c1ccn(C)n1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:30.34,wD:27.30,(6.27,.46,;5.5,-.88,;3.96,-.88,;3.19,.46,;3.96,1.79,;5.5,1.79,;5.97,3.26,;4.73,4.16,;4.73,5.7,;3.48,3.26,;1.65,.46,;.74,1.7,;-.72,1.23,;-2.05,2,;-3.39,1.23,;-3.39,-.31,;-2.05,-1.08,;-2.05,-2.62,;-.72,-3.39,;-.72,-4.93,;-2.05,-5.7,;-3.39,-4.93,;-4.72,-5.7,;-3.39,-3.39,;-.72,-.31,;.74,-.79,;1.14,-2.28,;2.63,-2.67,;3.03,-4.16,;4.52,-4.56,;5.6,-3.47,;7.09,-3.87,;5.21,-1.98,;3.72,-1.58,;-4.72,2,;-6.19,1.52,;-7.09,2.77,;-6.19,4.01,;-6.96,5.35,;-4.72,3.54,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(OCC(F)(F)F)c2ccccn2)CC1 |r,wU:4.4,wD:1.0,(1.78,-7.43,;2.17,-5.94,;3.66,-5.54,;4.06,-4.05,;2.97,-2.97,;3.37,-1.48,;1.66,.23,;2.56,1.48,;1.66,2.72,;.19,2.25,;-1.14,3.02,;-2.47,2.25,;-2.47,.71,;-1.14,-.06,;-1.14,-1.6,;.19,-2.37,;.19,-3.91,;-1.14,-4.68,;-2.47,-3.91,;-3.81,-4.68,;-2.47,-2.37,;.19,.71,;-3.81,3.02,;-3.81,4.56,;-5.27,5.03,;-6.18,3.79,;-7.72,3.79,;-5.27,2.54,;4.05,1.88,;4.45,3.36,;3.36,4.45,;3.76,5.94,;2.67,7.03,;4.16,7.43,;5.25,6.34,;5.14,.79,;6.63,1.19,;7.72,.1,;7.32,-1.39,;5.83,-1.79,;4.74,-.7,;1.48,-3.36,;1.09,-4.85,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(=O)c2ccccc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;6.27,.64,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ccccc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;2.42,1.97,;3.96,-.7,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;6.27,.64,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ccccc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.73,.64,;3.96,-.7,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;6.27,.64,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ccc(F)cc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;2.42,1.75,;3.96,-.92,;3.96,1.75,;3.19,3.08,;3.96,4.41,;5.5,4.41,;6.27,5.75,;6.27,3.08,;5.5,1.75,;6.27,.41,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ncccc2F)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-3.39,-3.21,;-3.39,-4.75,;-2.05,-5.52,;-.72,-4.75,;.61,-5.52,;-.72,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;4.73,.64,;3.96,1.97,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;1.65,3.3,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ccncc2F)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;3.6,-.9,;4.93,-.13,;4.37,1.97,;3.6,3.3,;4.37,4.64,;5.91,4.64,;6.68,3.3,;5.91,1.97,;6.68,.64,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ncccc2C)CC1 |r,wU:4.4,wD:1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;3.6,-.9,;4.93,-.13,;4.37,1.97,;3.6,3.3,;4.37,4.64,;5.91,4.64,;6.68,3.3,;5.91,1.97,;6.68,.64,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)(F)c2ccccn2)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.73,.64,;3.96,-.7,;3.96,1.97,;3.19,3.3,;3.96,4.64,;5.5,4.64,;6.27,3.3,;5.5,1.97,;3.03,-3.98,;4.52,-4.38,)|
COCC(C)(F)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;2.83,1.97,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CC(c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1ncccc1F |r,wU:19.21,wD:22.25,(3.96,-.7,;3.19,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-3.39,-3.21,;-3.39,-4.75,;-2.05,-5.52,;-.72,-4.75,;.61,-5.52,;-.72,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.96,1.97,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;1.65,3.3,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(=C)c2ccccc2)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;3.96,1.97,;5.5,1.97,;6.27,3.3,;5.5,4.64,;3.96,4.64,;3.19,3.3,;3.03,-3.98,;4.52,-4.38,)|
COCC(c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1)c1ccccc1 |r,wU:24.27,wD:21.23,(3.76,6.88,;3.36,5.39,;4.45,4.3,;4.05,2.81,;2.56,2.41,;1.66,3.66,;.19,3.18,;-1.14,3.95,;-2.47,3.18,;-2.47,1.64,;-1.14,.87,;-1.14,-3.8,;.19,-4.57,;.19,-6.11,;-1.14,-6.88,;-2.47,-6.11,;-3.81,-6.88,;-2.47,-4.57,;.19,1.64,;1.66,1.17,;2.75,.08,;2.35,-1.41,;.86,-1.81,;.46,-3.3,;1.55,-4.38,;1.15,-5.87,;3.04,-3.99,;3.44,-2.5,;-3.81,3.95,;-3.81,5.49,;-5.27,5.97,;-6.18,4.72,;-7.72,4.72,;-5.27,3.48,;5.14,1.72,;4.74,.23,;5.83,-.85,;7.32,-.46,;7.72,1.03,;6.63,2.12,)|
CCCC(=C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:22.24,wD:25.28,(6.27,3.3,;5.5,1.97,;3.96,1.97,;3.19,.64,;3.96,-.7,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCCC(COC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.26,wD:27.30,(6.27,3.3,;5.5,1.97,;3.96,1.97,;3.19,.64,;3.96,-.7,;5.45,-.3,;6.54,-1.39,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)C(C)=C)CC1 |r,wU:4.4,wD:1.0,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,1.97,;3.96,-.7,;3.03,-3.98,;4.52,-4.38,)|
COCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:22.24,wD:25.28,(6.54,-1.39,;5.45,-.3,;3.96,-.7,;3.19,.64,;3.96,1.97,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCOCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(3.19,5.75,;3.96,4.41,;3.19,3.08,;3.96,1.75,;3.19,.41,;3.96,-.92,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;.74,-.83,;1.14,-2.32,;2.63,-2.72,;3.72,-1.63,;5.21,-2.03,;5.6,-3.52,;7.09,-3.92,;4.52,-4.61,;3.03,-4.21,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,)|
CC(C)OCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.26,wD:27.30,(3.19,5.75,;3.96,4.41,;5.5,4.41,;3.19,3.08,;3.96,1.75,;3.19,.41,;3.96,-.92,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;.74,-.83,;1.14,-2.32,;2.63,-2.72,;3.72,-1.63,;5.21,-2.03,;5.6,-3.52,;7.09,-3.92,;4.52,-4.61,;3.03,-4.21,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,)|
CCC(COC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;3.19,3.3,;3.96,4.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
COCC(COC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.26,wD:27.30,(6.27,3.3,;5.5,1.97,;3.96,1.97,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
COCC(C(C)C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.26,wD:27.30,(7.04,-.7,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;5.5,1.97,;3.19,3.3,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CC(C)c1ccnc(c1)-c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:29.33,wD:26.29,(7.45,3.3,;5.91,3.3,;5.14,4.64,;5.14,1.97,;5.91,.64,;5.14,-.7,;3.6,-.7,;2.83,.64,;3.6,1.97,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-3.75,-3.21,;-3.75,-4.75,;-2.41,-5.52,;-1.08,-4.75,;.25,-5.52,;-1.08,-3.21,;-1.08,-.13,;.39,-.61,;.78,-2.1,;2.27,-2.5,;2.67,-3.98,;4.16,-4.38,;5.25,-3.29,;6.73,-3.69,;4.85,-1.81,;3.36,-1.41,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3c(Br)c(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,34.39,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-2.05,3.49,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-4.72,-5.75,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3c(Cl)c(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,33.37,wD:1.0,37.40,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-2.05,3.72,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3c(F)c(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,33.37,wD:1.0,37.40,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-2.05,3.72,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
COc1c(nc(-c2cncc(Cl)c2)c2n(C[C@H]3CC[C@H](C)CC3)c(nc12)N1CCO[C@@H]2CCC[C@@H]12)-c1noc(=O)[nH]1 |r,wU:16.16,30.34,wD:19.20,34.37,(.05,5,;-1.28,4.23,;-1.28,2.69,;-2.62,1.93,;-2.62,.38,;-1.28,-.38,;-1.28,-1.93,;.05,-2.69,;.05,-4.23,;-1.28,-5,;-2.62,-4.23,;-3.95,-5,;-2.62,-2.69,;.05,.38,;1.51,-.09,;1.91,-1.58,;3.4,-1.98,;4.49,-.89,;5.98,-1.29,;6.37,-2.77,;7.86,-3.17,;5.29,-3.86,;3.8,-3.46,;2.42,1.15,;1.51,2.4,;.05,1.93,;3.96,1.15,;4.73,-.18,;6.27,-.18,;7.04,1.15,;6.27,2.49,;6.74,3.95,;5.5,4.86,;4.25,3.95,;4.73,2.49,;-3.95,2.69,;-3.95,4.23,;-5.42,4.71,;-6.32,3.47,;-7.86,3.47,;-5.42,2.22,)|
C[C@H]1CC[C@H](Cn2c(nc3c(C)c(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,33.37,wD:1.0,37.40,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-2.05,3.72,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3c(N(C)C)c(nc(-c4cncc(Cl)c4)c23)C(O)=O)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,32.35,wD:1.0,36.38,(6.57,-3.17,;5.09,-2.77,;4.69,-1.29,;3.2,-.89,;2.11,-1.98,;.62,-1.58,;.23,-.09,;1.13,1.15,;.23,2.4,;-1.24,1.93,;-2.57,2.69,;-2.57,4.23,;-1.24,5,;-3.91,5,;-3.91,1.93,;-3.91,.38,;-2.57,-.38,;-2.57,-1.93,;-1.24,-2.69,;-1.24,-4.23,;-2.57,-5,;-3.91,-4.23,;-5.24,-5,;-3.91,-2.69,;-1.24,.38,;-5.24,2.69,;-6.57,1.93,;-5.24,4.23,;2.67,1.15,;3.44,-.18,;4.98,-.18,;5.75,1.15,;4.98,2.49,;5.46,3.95,;4.21,4.86,;2.96,3.95,;3.44,2.49,;2.51,-3.46,;4,-3.86,)|
COCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(6.27,-2.03,;5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;.05,-3.19,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
COCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(7.68,-2.03,;6.91,-.7,;5.37,-.7,;4.6,.64,;5.37,1.97,;3.06,.64,;2.16,1.88,;.69,1.41,;-.64,2.18,;-1.97,1.41,;-1.97,-.13,;-.64,-.9,;-.64,-2.44,;.69,-3.21,;.69,-4.75,;-.64,-5.52,;-1.97,-4.75,;-3.31,-5.52,;-1.97,-3.21,;.69,-.13,;2.16,-.61,;2.56,-2.1,;1.47,-3.19,;4.04,-2.5,;5.13,-1.41,;6.62,-1.81,;7.02,-3.29,;8.51,-3.69,;5.93,-4.38,;4.44,-3.98,;-3.31,2.18,;-4.77,1.7,;-5.68,2.95,;-4.77,4.19,;-5.54,5.52,;-3.31,3.72,)|
COCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(6.87,-1.13,;5.78,-.05,;4.29,-.45,;3.19,.64,;3.96,1.97,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;.05,-3.19,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
COCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(6.85,-1.14,;5.77,-.06,;4.28,-.45,;3.19,.64,;3.96,1.97,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;.05,-3.19,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(=O)NS(C)(=O)=O)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:1.0,33.36,wD:4.4,37.39,(7.91,-3.1,;6.42,-2.7,;5.33,-3.79,;3.84,-3.39,;3.45,-1.9,;1.96,-1.51,;1.56,-.02,;2.46,1.23,;1.56,2.47,;.09,2,;-1.24,2.77,;-2.57,2,;-2.57,.46,;-1.24,-.31,;-1.24,-1.85,;.09,-2.62,;.09,-4.16,;-1.24,-4.93,;-2.57,-4.16,;-3.91,-4.93,;-2.57,-2.62,;.09,.46,;-3.91,2.77,;-3.91,4.31,;-5.24,2,;-6.57,2.77,;-7.91,2,;-7.34,4.1,;-5.8,4.1,;4,1.23,;4.77,-.11,;6.31,-.11,;7.08,1.23,;6.31,2.56,;6.79,4.03,;5.54,4.93,;4.3,4.03,;4.77,2.56,;4.53,-.81,;6.02,-1.21,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(=O)NS(=O)(=O)N(C)C)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:1.0,35.38,wD:4.4,39.41,(8.65,-3.1,;7.16,-2.7,;6.08,-3.79,;4.59,-3.39,;4.19,-1.9,;2.7,-1.51,;2.3,-.02,;3.21,1.23,;2.3,2.47,;.84,2,;-.5,2.77,;-1.83,2,;-1.83,.46,;-.5,-.31,;-.5,-1.85,;.84,-2.62,;.84,-4.16,;-.5,-4.93,;-1.83,-4.16,;-3.16,-4.93,;-1.83,-2.62,;.84,.46,;-3.16,2.77,;-3.16,4.31,;-4.5,2,;-5.83,2.77,;-6.6,4.1,;-5.06,4.1,;-7.16,2,;-7.56,.51,;-8.65,2.4,;4.75,1.23,;5.52,-.11,;7.06,-.11,;7.83,1.23,;7.06,2.56,;7.53,4.03,;6.29,4.93,;5.04,4.03,;5.52,2.56,;5.28,-.81,;6.77,-1.21,)|
CNC(=O)c1cc2nc(N3CCOC[C@H]3c3ccccc3)n(C[C@H]3CC[C@H](C)CC3)c2c(n1)-c1cncc(Cl)c1 |r,wU:23.24,wD:26.28,14.15,(-6.57,-.36,;-6.57,1.18,;-5.24,1.95,;-5.24,3.49,;-3.91,1.18,;-2.57,1.95,;-1.24,1.18,;.23,1.66,;1.13,.41,;2.67,.41,;3.44,-.92,;4.98,-.92,;5.75,.41,;4.98,1.75,;3.44,1.75,;2.67,3.08,;3.44,4.41,;2.67,5.75,;1.13,5.75,;.36,4.41,;1.13,3.08,;.23,-.83,;.62,-2.32,;2.11,-2.72,;3.2,-1.63,;4.69,-2.03,;5.09,-3.52,;6.57,-3.92,;4,-4.61,;2.51,-4.21,;-1.24,-.36,;-2.57,-1.13,;-3.91,-.36,;-2.57,-2.67,;-1.24,-3.44,;-1.24,-4.98,;-2.57,-5.75,;-3.91,-4.98,;-5.24,-5.75,;-3.91,-3.44,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C(=O)N(C)C)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,32.36,(7.24,-3.92,;5.75,-3.52,;5.35,-2.03,;3.87,-1.63,;2.78,-2.72,;1.29,-2.32,;.89,-.83,;1.8,.41,;.89,1.66,;-.57,1.18,;-1.91,1.95,;-3.24,1.18,;-3.24,-.36,;-1.91,-1.13,;-1.91,-2.67,;-.57,-3.44,;-.57,-4.98,;-1.91,-5.75,;-3.24,-4.98,;-4.57,-5.75,;-3.24,-3.44,;-.57,-.36,;-4.57,1.95,;-4.57,3.49,;-5.91,1.18,;-7.24,1.95,;-5.91,-.36,;3.34,.41,;4.11,-.92,;5.65,-.92,;6.42,.41,;5.65,1.75,;4.11,1.75,;3.34,3.08,;4.11,4.41,;3.34,5.75,;1.8,5.75,;1.03,4.41,;1.8,3.08,;3.18,-4.21,;4.66,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(NS(C)(=O)=O)nc(-c4cncc(Cl)c4)c23)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:1.0,wD:32.36,4.4,(6.64,-5.45,;5.3,-4.68,;3.97,-5.45,;2.64,-4.68,;2.64,-3.14,;1.3,-2.37,;1.3,-.83,;2.21,.41,;1.3,1.66,;-.16,1.18,;-1.49,1.95,;-2.83,1.18,;-4.16,1.95,;-5.5,1.18,;-6.83,.41,;-6.27,2.52,;-4.73,-.15,;-2.83,-.36,;-1.49,-1.13,;-1.49,-2.67,;-.16,-3.44,;-.16,-4.98,;-1.49,-5.75,;-2.83,-4.98,;-4.16,-5.75,;-2.83,-3.44,;-.16,-.36,;3.75,.41,;4.52,-.92,;6.06,-.92,;6.83,.41,;6.06,1.75,;4.52,1.75,;3.75,3.08,;4.52,4.41,;3.75,5.75,;2.21,5.75,;1.44,4.41,;2.21,3.08,;3.97,-2.37,;5.3,-3.14,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2nnn[nH]2)N2CCC[C@H]2C(F)(F)F)CC1 |r,wU:1.0,wD:4.4,31.36,(7.09,-3.36,;5.6,-2.96,;4.52,-4.05,;3.03,-3.65,;2.63,-2.16,;1.14,-1.76,;.74,-.28,;1.65,.97,;.74,2.22,;-.72,1.74,;-2.05,2.51,;-3.39,1.74,;-3.39,.2,;-2.05,-.57,;-2.05,-2.11,;-.72,-2.88,;-.72,-4.42,;-2.05,-5.19,;-3.39,-4.42,;-4.72,-5.19,;-3.39,-2.88,;-.72,.2,;-4.72,2.51,;-6.19,2.03,;-7.09,3.28,;-6.19,4.53,;-4.72,4.05,;3.19,.97,;4.09,-.28,;5.56,.2,;5.56,1.74,;4.09,2.22,;3.7,3.7,;2.21,4.1,;4.78,4.79,;3.3,5.19,;3.72,-1.07,;5.21,-1.47,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2nc(=O)n(C)[nH]2)N2CCC[C@H]2CF)CC1 |r,wU:1.0,wD:4.4,33.38,(7.86,-3.69,;6.37,-3.29,;5.29,-4.38,;3.8,-3.98,;3.4,-2.5,;1.91,-2.1,;1.51,-.61,;2.42,.64,;1.51,1.88,;.05,1.41,;-1.28,2.18,;-2.62,1.41,;-2.62,-.13,;-1.28,-.9,;-1.28,-2.44,;.05,-3.21,;.05,-4.75,;-1.28,-5.52,;-2.62,-4.75,;-3.95,-5.52,;-2.62,-3.21,;.05,-.13,;-3.95,2.18,;-3.95,3.72,;-5.42,4.19,;-6.19,5.52,;-6.32,2.95,;-7.86,2.95,;-5.42,1.7,;3.96,.64,;4.86,-.61,;6.33,-.13,;6.33,1.41,;4.86,1.88,;4.47,3.37,;5.55,4.46,;4.49,-1.41,;5.98,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)[nH]2)N2CCC[C@H]2CF)CC1 |r,wU:1.0,wD:4.4,32.37,(7.09,-3.69,;5.6,-3.29,;4.52,-4.38,;3.03,-3.98,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;4.09,-.61,;5.56,-.13,;5.56,1.41,;4.09,1.88,;3.7,3.37,;4.78,4.46,;3.72,-1.41,;5.21,-1.81,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2nnn[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:1.0,31.35,wD:4.4,35.38,(7.09,-3.1,;5.6,-2.7,;4.52,-3.79,;3.03,-3.39,;2.63,-1.9,;1.14,-1.51,;.74,-.02,;1.65,1.23,;.74,2.47,;-.72,2,;-2.05,2.77,;-3.39,2,;-3.39,.46,;-2.05,-.31,;-2.05,-1.85,;-.72,-2.62,;-.72,-4.16,;-2.05,-4.93,;-3.39,-4.16,;-4.72,-4.93,;-3.39,-2.62,;-.72,.46,;-4.72,2.77,;-6.19,2.29,;-7.09,3.54,;-6.19,4.78,;-4.72,4.31,;3.19,1.23,;3.96,-.11,;5.5,-.11,;6.27,1.23,;5.5,2.56,;5.97,4.03,;4.73,4.93,;3.48,4.03,;3.96,2.56,;3.72,-.81,;5.21,-1.21,)|
COC(=O)c1cc2nc(N3CCOC[C@H]3c3ccccc3)n(C[C@H]3CC[C@H](C)CC3)c2c(n1)-c1cncc(Cl)c1 |r,wU:23.24,wD:26.28,14.15,(-7.24,1.95,;-5.91,1.18,;-4.57,1.95,;-4.57,3.49,;-3.24,1.18,;-1.91,1.95,;-.57,1.18,;.89,1.66,;1.8,.41,;3.34,.41,;4.11,-.92,;5.65,-.92,;6.42,.41,;5.65,1.75,;4.11,1.75,;3.34,3.08,;4.11,4.41,;3.34,5.75,;1.8,5.75,;1.03,4.41,;1.8,3.08,;.89,-.83,;1.29,-2.32,;2.78,-2.72,;3.87,-1.63,;5.35,-2.03,;5.75,-3.52,;7.24,-3.92,;4.66,-4.61,;3.18,-4.21,;-.57,-.36,;-1.91,-1.13,;-3.24,-.36,;-1.91,-2.67,;-.57,-3.44,;-.57,-4.98,;-1.91,-5.75,;-3.24,-4.98,;-4.57,-5.75,;-3.24,-3.44,)|
CCOC(=O)c1cc2nc(N3CCOC[C@H]3c3ccccc3)n(CC3CC[C@H](C)CC3)c2c(n1)-c1cncc(Cl)c1 |r,wD:15.16,27.29,(-7.5,.95,;-6.16,1.72,;-4.83,.95,;-3.49,1.72,;-3.49,3.26,;-2.16,.95,;-.83,1.72,;.51,.95,;1.97,1.43,;2.88,.18,;4.42,.18,;5.19,-1.15,;6.73,-1.15,;7.5,.18,;6.73,1.52,;5.19,1.52,;4.79,3,;5.88,4.09,;5.48,5.58,;3.99,5.98,;2.9,4.89,;3.3,3.4,;1.97,-1.06,;1.97,-2.6,;3.3,-3.37,;4.64,-2.6,;5.97,-3.37,;5.97,-4.91,;7.31,-5.68,;4.64,-5.68,;3.3,-4.91,;.51,-.59,;-.83,-1.36,;-2.16,-.59,;-.83,-2.9,;.51,-3.67,;.51,-5.21,;-.83,-5.98,;-2.16,-5.21,;-3.49,-5.98,;-2.16,-3.67,)|
CCON(C1CC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.28,wD:28.32,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;5.7,2.75,;4.37,3.51,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;.39,-3.48,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CCOC(C1CC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.28,wD:28.32,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;5.7,2.75,;4.37,3.51,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;.07,-3.24,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CCOC(C1CC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.28,wD:28.32,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;5.7,2.74,;4.37,3.51,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;.07,-3.24,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CCOC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(6.68,-2.03,;5.91,-.7,;4.37,-.7,;3.6,.64,;4.37,1.97,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;1.16,-.61,;1.16,-2.15,;.07,-3.24,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
CCOC(COC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.27,wD:28.31,(7.04,-1.59,;6.27,-.25,;4.73,-.25,;3.96,1.08,;4.73,2.41,;3.96,3.75,;4.73,5.08,;2.42,1.08,;1.51,2.33,;.05,1.85,;-1.28,2.62,;-2.62,1.85,;-2.62,.31,;-1.28,-.46,;-1.28,-2,;.05,-2.77,;.05,-4.31,;-1.28,-5.08,;-2.62,-4.31,;-3.95,-5.08,;-2.62,-2.77,;.05,.31,;1.51,-.17,;1.91,-1.65,;.82,-2.74,;3.4,-2.05,;4.49,-.96,;5.98,-1.36,;6.37,-2.85,;7.86,-3.25,;5.29,-3.94,;3.8,-3.54,;-3.95,2.62,;-3.95,4.16,;-5.42,4.64,;-6.32,3.39,;-7.86,3.39,;-5.42,2.14,)|
CCON(COC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C(C)[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.27,wD:28.31,(7.04,-1.59,;6.27,-.25,;4.73,-.25,;3.96,1.08,;4.73,2.41,;3.95,3.74,;4.72,5.08,;2.42,1.08,;1.51,2.33,;.05,1.85,;-1.28,2.62,;-2.62,1.85,;-2.62,.31,;-1.28,-.46,;-1.28,-2,;.05,-2.77,;.05,-4.31,;-1.28,-5.08,;-2.62,-4.31,;-3.95,-5.08,;-2.62,-2.77,;.05,.31,;1.51,-.17,;1.91,-1.65,;.82,-2.74,;3.4,-2.05,;4.49,-.96,;5.98,-1.36,;6.37,-2.85,;7.86,-3.25,;5.29,-3.94,;3.8,-3.54,;-3.95,2.62,;-3.95,4.16,;-5.42,4.64,;-6.32,3.39,;-7.86,3.39,;-5.42,2.14,)|
CC([C@H]1CC[C@H](C)CC1)n1c(nc2cc(nc(-c3cncc(Cl)c3)c12)-c1noc(=O)[nH]1)N1CCN(C[C@H]1C)C(=O)C1(F)CC1 |r,wU:2.1,wD:5.5,36.42,(-1.36,-3.19,;-.27,-2.1,;1.22,-2.5,;2.31,-1.41,;3.8,-1.81,;4.19,-3.29,;5.68,-3.69,;3.11,-4.38,;1.62,-3.98,;-.67,-.61,;.24,.64,;-.67,1.88,;-2.13,1.41,;-3.47,2.18,;-4.8,1.41,;-4.8,-.13,;-3.47,-.9,;-3.47,-2.44,;-2.13,-3.21,;-2.13,-4.75,;-3.47,-5.52,;-4.8,-4.75,;-6.13,-5.52,;-4.8,-3.21,;-2.13,-.13,;-6.13,2.18,;-7.6,1.7,;-8.5,2.95,;-7.6,4.19,;-8.37,5.52,;-6.13,3.72,;1.78,.64,;2.55,-.7,;4.09,-.7,;4.86,.64,;4.09,1.97,;2.55,1.97,;1.78,3.3,;6.4,.64,;7.17,1.97,;7.17,-.7,;8.26,.39,;7.17,-2.24,;8.5,-1.47,)|
FC(F)(F)c1ccc(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)cc1 |r|
CC[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:5.5,33.37,wD:2.1,37.40,(7.64,-2.6,;6.55,-3.69,;5.06,-3.29,;4.66,-1.81,;3.17,-1.41,;2.09,-2.5,;.6,-2.1,;.2,-.61,;1.1,.64,;.2,1.88,;-1.27,1.41,;-2.6,2.18,;-3.93,1.41,;-3.93,-.13,;-2.6,-.9,;-2.6,-2.44,;-1.27,-3.21,;-1.27,-4.75,;-2.6,-5.52,;-3.93,-4.75,;-5.27,-5.52,;-3.93,-3.21,;-1.27,-.13,;-5.27,2.18,;-6.73,1.7,;-7.64,2.95,;-6.73,4.19,;-7.5,5.52,;-5.27,3.72,;2.64,.64,;3.41,-.7,;4.95,-.7,;5.72,.64,;4.95,1.97,;5.43,3.43,;4.18,4.34,;2.94,3.43,;3.41,1.97,;2.48,-3.98,;3.97,-4.38,)|
CC[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2n[nH]c(=O)o2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:5.5,33.37,wD:2.1,37.40,(7.64,-2.6,;6.55,-3.69,;5.06,-3.29,;4.66,-1.81,;3.17,-1.41,;2.09,-2.5,;.6,-2.1,;.2,-.61,;1.1,.64,;.2,1.88,;-1.27,1.41,;-2.6,2.18,;-3.93,1.41,;-3.93,-.13,;-2.6,-.9,;-2.6,-2.44,;-1.27,-3.21,;-1.27,-4.75,;-2.6,-5.52,;-3.93,-4.75,;-5.27,-5.52,;-3.93,-3.21,;-1.27,-.13,;-5.27,2.18,;-6.73,1.7,;-7.64,2.95,;-6.73,4.19,;-7.5,5.52,;-5.27,3.72,;2.64,.64,;3.41,-.7,;4.95,-.7,;5.72,.64,;4.95,1.97,;5.43,3.43,;4.18,4.34,;2.94,3.43,;3.41,1.97,;2.48,-3.98,;3.97,-4.38,)|
Fc1cc(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)ccc1C(F)(F)F |r|
FC(F)(F)[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:35.39,7.7,wD:39.42,4.3,(7.25,-3.84,;5.92,-4.61,;5.92,-6.15,;7.25,-5.38,;4.58,-3.84,;4.58,-2.3,;3.25,-1.53,;1.92,-2.3,;.58,-1.53,;.58,.01,;1.49,1.26,;.58,2.5,;-.88,2.03,;-2.21,2.8,;-3.55,2.03,;-3.55,.49,;-2.21,-.28,;-2.21,-1.82,;-.88,-2.59,;-.88,-4.13,;-2.21,-4.9,;-3.55,-4.13,;-4.88,-4.9,;-3.55,-2.59,;-.88,.49,;-4.88,2.8,;-6.35,2.32,;-7.25,3.57,;-6.35,4.81,;-7.12,6.15,;-4.88,4.34,;3.03,1.26,;3.8,-.08,;5.34,-.08,;6.11,1.26,;5.34,2.59,;5.81,4.06,;4.57,4.96,;3.32,4.06,;3.8,2.59,;1.92,-3.84,;3.25,-4.61,)|
CCC1CCC(Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)C1 |r|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cc(Cl)cnc4N(C)C)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,35.39,wD:1.0,39.42,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;.61,-5.52,;-2.05,-5.52,;-3.39,-4.75,;-3.39,-3.21,;-4.72,-2.44,;-6.06,-3.21,;-4.72,-.9,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cc(Cl)cnc4C)c23)-c2noc(=O)[nH]2)N2CCO[C@H]3CCC[C@H]23)CC1 |r,wU:4.4,37.40,wD:1.0,33.37,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;.61,-5.52,;-2.05,-5.52,;-3.39,-4.75,;-3.39,-3.21,;-4.72,-2.44,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cc(Cl)cnc4C)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,33.37,wD:1.0,37.40,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;.61,-5.52,;-2.05,-5.52,;-3.39,-4.75,;-3.39,-3.21,;-4.72,-2.44,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cc(Cl)cnc4OCCO)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:36.40,4.4,wD:40.43,1.0,(7.31,-5.23,;5.97,-4.46,;5.97,-2.92,;4.64,-2.15,;3.3,-2.92,;1.97,-2.15,;1.97,-.61,;2.88,.64,;1.97,1.88,;.51,1.41,;-.83,2.18,;-2.16,1.41,;-2.16,-.13,;-.83,-.9,;-.83,-2.44,;.51,-3.21,;.51,-4.75,;1.84,-5.52,;-.83,-5.52,;-2.16,-4.75,;-2.16,-3.21,;-3.49,-2.44,;-4.83,-3.21,;-6.16,-2.44,;-7.5,-3.21,;.51,-.13,;-3.49,2.18,;-4.96,1.7,;-5.86,2.95,;-4.96,4.19,;-5.73,5.52,;-3.49,3.72,;4.42,.64,;5.19,-.7,;6.73,-.7,;7.5,.64,;6.73,1.97,;7.2,3.43,;5.96,4.34,;4.71,3.43,;5.19,1.97,;3.3,-4.46,;4.64,-5.23,)|
COc1ncc(Cl)cc1-c1nc(cc2nc(N3CCO[C@H]4CCC[C@H]34)n(C[C@H]3CC[C@H](C)CC3)c12)-c1noc(=O)[nH]1 |r,wU:24.24,27.29,wD:20.21,30.33,(-5.64,-3.21,;-4.31,-2.44,;-2.98,-3.21,;-2.98,-4.75,;-1.64,-5.52,;-.31,-4.75,;1.02,-5.52,;-.31,-3.21,;-1.64,-2.44,;-1.64,-.9,;-2.98,-.13,;-2.98,1.41,;-1.64,2.18,;-.31,1.41,;1.16,1.88,;2.06,.64,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
COc1ncc(Cl)cc1-c1nc(cc2nc(N3CCO[C@@H]4CCC[C@@H]34)n(C[C@H]3CC[C@H](C)CC3)c12)-c1noc(=O)[nH]1 |r,wU:20.21,27.29,wD:24.24,30.33,(-5.64,-3.21,;-4.31,-2.44,;-2.98,-3.21,;-2.98,-4.75,;-1.64,-5.52,;-.31,-4.75,;1.02,-5.52,;-.31,-3.21,;-1.64,-2.44,;-1.64,-.9,;-2.98,-.13,;-2.98,1.41,;-1.64,2.18,;-.31,1.41,;1.16,1.88,;2.06,.64,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
COCCOc1ncc(Cl)cc1-c1nc(cc2nc(N3CCO[C@@H]4CCC[C@@H]34)n(C[C@H]3CC[C@H](C)CC3)c12)-c1noc(=O)[nH]1 |r,wU:23.24,30.32,wD:27.27,33.36,(-8.16,-2.44,;-6.83,-3.21,;-5.5,-2.44,;-4.16,-3.21,;-2.83,-2.44,;-1.49,-3.21,;-1.49,-4.75,;-.16,-5.52,;1.17,-4.75,;2.51,-5.52,;1.17,-3.21,;-.16,-2.44,;-.16,-.9,;-1.49,-.13,;-1.49,1.41,;-.16,2.18,;1.17,1.41,;2.64,1.88,;3.54,.64,;5.08,.64,;5.85,-.7,;7.39,-.7,;8.16,.64,;7.39,1.97,;7.87,3.43,;6.62,4.34,;5.38,3.43,;5.85,1.97,;2.64,-.61,;2.64,-2.15,;3.97,-2.92,;5.3,-2.15,;6.64,-2.92,;6.64,-4.46,;7.97,-5.23,;5.3,-5.23,;3.97,-4.46,;1.17,-.13,;-2.83,2.18,;-4.29,1.7,;-5.2,2.95,;-4.29,4.19,;-5.06,5.52,;-2.83,3.72,)|
COCCOc1ncc(Cl)cc1-c1nc(cc2nc(N3CCO[C@H]4CCC[C@H]34)n(C[C@H]3CC[C@H](C)CC3)c12)-c1noc(=O)[nH]1 |r,wU:27.27,30.32,wD:23.24,33.36,(-8.16,-2.44,;-6.83,-3.21,;-5.5,-2.44,;-4.16,-3.21,;-2.83,-2.44,;-1.49,-3.21,;-1.49,-4.75,;-.16,-5.52,;1.17,-4.75,;2.51,-5.52,;1.17,-3.21,;-.16,-2.44,;-.16,-.9,;-1.49,-.13,;-1.49,1.41,;-.16,2.18,;1.17,1.41,;2.64,1.88,;3.54,.64,;5.08,.64,;5.85,-.7,;7.39,-.7,;8.16,.64,;7.39,1.97,;7.87,3.43,;6.62,4.34,;5.38,3.43,;5.85,1.97,;2.64,-.61,;2.64,-2.15,;3.97,-2.92,;5.3,-2.15,;6.64,-2.92,;6.64,-4.46,;7.97,-5.23,;5.3,-5.23,;3.97,-4.46,;1.17,-.13,;-2.83,2.18,;-4.29,1.7,;-5.2,2.95,;-4.29,4.19,;-5.06,5.52,;-2.83,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cc(Cl)c[nH]c4=O)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:4.4,33.37,wD:1.0,37.40,(7.09,-3.69,;5.6,-3.29,;5.21,-1.81,;3.72,-1.41,;2.63,-2.5,;1.14,-2.1,;.74,-.61,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;.61,-5.52,;-2.05,-5.52,;-3.39,-4.75,;-3.39,-3.21,;-4.72,-2.44,;-.72,-.13,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.27,.64,;5.5,1.97,;5.97,3.43,;4.73,4.34,;3.48,3.43,;3.96,1.97,;3.03,-3.98,;4.52,-4.38,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(C)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CCC[C@@H]23)CC1 |r,wU:32.36,4.4,wD:36.39,1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-2.98,-3.21,;-2.98,-4.75,;-1.64,-5.52,;-.31,-4.75,;1.02,-5.52,;-.31,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(C)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@H]3CCC[C@H]23)CC1 |r,wU:4.4,36.39,wD:1.0,32.36,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-2.98,-3.21,;-2.98,-4.75,;-1.64,-5.52,;-.31,-4.75,;1.02,-5.52,;-.31,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
CNc1ncc(Cl)cc1-c1nc(cc2nc(N3CCO[C@@H]4CCC[C@@H]34)n(C[C@H]3CC[C@H](C)CC3)c12)-c1noc(=O)[nH]1 |r,wU:27.29,20.21,wD:30.33,24.24,(-5.64,-3.21,;-4.31,-2.44,;-2.98,-3.21,;-2.98,-4.75,;-1.64,-5.52,;-.31,-4.75,;1.02,-5.52,;-.31,-3.21,;-1.64,-2.44,;-1.64,-.9,;-2.98,-.13,;-2.98,1.41,;-1.64,2.18,;-.31,1.41,;1.16,1.88,;2.06,.64,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.39,3.43,;5.14,4.34,;3.89,3.43,;4.37,1.97,;1.16,-.61,;1.16,-2.15,;2.49,-2.92,;3.82,-2.15,;5.16,-2.92,;5.16,-4.46,;6.49,-5.23,;3.82,-5.23,;2.49,-4.46,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cc(Cl)c[nH]c4=O)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,34.39,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;.61,-5.75,;-2.05,-5.75,;-3.39,-4.98,;-3.39,-3.44,;-4.72,-2.67,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncnc4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,32.37,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cnccn4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,32.37,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-.72,-3.44,;-.72,-4.98,;-2.05,-5.75,;-3.39,-4.98,;-3.39,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4ccnnc4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,32.37,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-3.39,-3.44,;-3.39,-4.98,;-2.05,-5.75,;-.72,-4.98,;-.72,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cccnn4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,32.37,(7.09,-3.92,;5.6,-3.52,;5.21,-2.03,;3.72,-1.63,;2.63,-2.72,;1.14,-2.32,;.74,-.83,;1.65,.41,;.74,1.66,;-.72,1.18,;-2.05,1.95,;-3.39,1.18,;-3.39,-.36,;-2.05,-1.13,;-2.05,-2.67,;-3.39,-3.44,;-3.39,-4.98,;-2.05,-5.75,;-.72,-4.98,;-.72,-3.44,;-.72,-.36,;-4.72,1.95,;-6.19,1.48,;-7.09,2.72,;-6.19,3.97,;-6.96,5.3,;-4.72,3.49,;3.19,.41,;3.96,-.92,;5.5,-.92,;6.27,.41,;5.5,1.75,;3.96,1.75,;3.19,3.08,;3.96,4.41,;3.19,5.75,;1.65,5.75,;.88,4.41,;1.65,3.08,;3.03,-4.21,;4.52,-4.61,)|
CSCC(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:22.24,wD:25.28,(3.96,4.64,;3.19,3.3,;3.96,1.97,;3.19,.64,;3.96,-.7,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CC(CS(C)(=O)=O)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:24.26,wD:27.30,(3.96,-.7,;3.19,.64,;3.96,1.97,;3.19,3.3,;3.96,4.64,;1.85,4.07,;1.85,2.53,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCC(CSC)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:23.25,wD:26.29,(5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;3.19,3.3,;3.96,4.64,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CCC(CS(C)(=O)=O)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:25.27,wD:28.31,(5.5,-.7,;3.96,-.7,;3.19,.64,;3.96,1.97,;5.5,1.97,;6.27,.64,;4.73,.64,;6.27,3.3,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
CC(C)C(CS(C)(=O)=O)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.28,wD:29.32,(3.19,3.3,;3.96,1.97,;5.5,1.97,;3.19,.64,;3.96,-.7,;5.5,-.7,;6.59,-1.79,;5.5,.84,;6.83,.07,;1.65,.64,;.74,1.88,;-.72,1.41,;-2.05,2.18,;-3.39,1.41,;-3.39,-.13,;-2.05,-.9,;-2.05,-2.44,;-.72,-3.21,;-.72,-4.75,;-2.05,-5.52,;-3.39,-4.75,;-4.72,-5.52,;-3.39,-3.21,;-.72,-.13,;.74,-.61,;1.14,-2.1,;2.63,-2.5,;3.72,-1.41,;5.21,-1.81,;5.6,-3.29,;7.09,-3.69,;4.52,-4.38,;3.03,-3.98,;-4.72,2.18,;-6.19,1.7,;-7.09,2.95,;-6.19,4.19,;-6.96,5.52,;-4.72,3.72,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)C2CC=CC(=O)N2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,34.39,c:27,(7.31,-5.45,;5.97,-4.68,;5.97,-3.14,;4.64,-2.37,;3.3,-3.14,;1.97,-2.37,;1.97,-.83,;2.88,.41,;1.97,1.66,;.51,1.18,;-.83,1.95,;-2.16,1.18,;-2.16,-.36,;-.83,-1.13,;-.83,-2.67,;.51,-3.44,;.51,-4.98,;-.83,-5.75,;-2.16,-4.98,;-3.49,-5.75,;-2.16,-3.44,;.51,-.36,;-3.49,1.95,;-3.49,3.49,;-4.83,4.26,;-6.16,3.49,;-6.16,1.95,;-7.5,1.18,;-4.83,1.18,;4.42,.41,;5.19,-.92,;6.73,-.92,;7.5,.41,;6.73,1.75,;5.19,1.75,;4.42,3.08,;5.19,4.41,;4.42,5.75,;2.88,5.75,;2.11,4.41,;2.88,3.08,;3.3,-4.68,;4.64,-5.45,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(OCC4CCC4)c23)-c2noc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:1.0,wD:32.37,4.4,(6.49,-4.75,;5.16,-3.98,;3.82,-4.75,;2.49,-3.98,;2.49,-2.44,;1.16,-1.67,;1.16,-.13,;2.06,1.12,;1.16,2.36,;-.31,1.89,;-1.64,2.66,;-2.98,1.89,;-2.98,.35,;-1.64,-.42,;-1.64,-1.96,;-2.98,-2.73,;-2.98,-4.27,;-4.07,-5.36,;-2.98,-6.45,;-1.89,-5.36,;-.31,.35,;-4.31,2.66,;-5.78,2.18,;-6.68,3.43,;-5.78,4.67,;-6.55,6.01,;-4.31,4.2,;3.6,1.12,;4.37,-.22,;5.91,-.22,;6.68,1.12,;5.91,2.45,;4.37,2.45,;3.6,3.78,;4.37,5.12,;3.6,6.45,;2.06,6.45,;1.29,5.12,;2.06,3.78,;3.82,-1.67,;5.16,-2.44,)|
CC(Oc1nc(cc2nc(N3CCOC[C@H]3c3ccccc3)n(C[C@H]3CC[C@H](C)CC3)c12)-c1noc(=O)[nH]1)C1CCC1 |r,wU:27.29,wD:15.16,24.25,(-4.31,-1.96,;-2.98,-2.73,;-1.64,-1.96,;-1.64,-.42,;-2.98,.35,;-2.98,1.89,;-1.64,2.66,;-.31,1.89,;1.16,2.36,;2.06,1.12,;3.6,1.12,;4.37,-.22,;5.91,-.22,;6.68,1.12,;5.91,2.45,;4.37,2.45,;3.6,3.78,;4.37,5.12,;3.6,6.45,;2.06,6.45,;1.29,5.12,;2.06,3.78,;1.16,-.13,;1.16,-1.67,;2.49,-2.44,;2.49,-3.98,;3.82,-4.75,;5.16,-3.98,;6.49,-4.75,;5.16,-2.44,;3.82,-1.67,;-.31,.35,;-4.31,2.66,;-5.78,2.18,;-6.68,3.43,;-5.78,4.67,;-6.55,6.01,;-4.31,4.2,;-2.98,-4.27,;-4.07,-5.36,;-2.98,-6.45,;-1.89,-5.36,)|
COc1cc2CC(=O)N(C3CCCCC3)C(c3ccc(Cl)cc3)c2cc1OC(C)C
COc1cc2CC(=O)N(C3CCC(CC3)N(C)C(C)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;9.34,-5.39,;9.34,-6.93,;10.67,-4.62,;12,-5.39,;10.67,-3.08,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
CCN(C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O)C(C)=O |(8,-7.7,;9.34,-6.93,;9.34,-5.39,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,;-1.33,-.77,;-2.67,,;-4,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;10.67,-4.62,;12,-5.39,;10.67,-3.08,)|
COc1cc2CC(=O)N(C3CCC(CC3)NC(C)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;9.34,-5.39,;10.67,-4.62,;12,-5.39,;10.67,-3.08,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)N(C)CCO)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;9.34,-6.93,;10.67,-4.62,;12,-5.39,;13.34,-4.62,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)NC(N)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;9.34,-5.39,;10.67,-4.62,;10.67,-3.08,;12,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)N(C)C(N)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;9.34,-5.39,;9.34,-6.93,;10.67,-4.62,;10.67,-3.08,;12,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)N3CCNC3=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;9.5,-6.92,;11,-7.24,;11.77,-5.91,;10.74,-4.76,;11.06,-3.26,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)N(C)C(=O)CCO)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;9.34,-5.39,;9.34,-6.93,;10.67,-4.62,;10.67,-3.08,;12,-5.39,;13.34,-4.62,;14.67,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
CCCN(C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O)C(C)=O |(13.34,-4.62,;12,-5.39,;10.67,-4.62,;9.34,-5.39,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,;-1.33,-.77,;-2.67,,;-4,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;9.34,-6.93,;10.67,-7.7,;8,-7.7,)|
CCCN(C=O)C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O |(13.34,-4.62,;12,-5.39,;10.67,-4.62,;9.34,-5.39,;9.34,-6.93,;8,-7.7,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,;-1.33,-.77,;-2.67,,;-4,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,)|
CCCCN(C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O)C(C)=O |(13.39,7.49,;12.62,6.16,;11.08,6.16,;10.31,4.83,;8.77,4.83,;8,3.49,;8.77,2.16,;8,.83,;6.46,.83,;5.69,2.16,;6.46,3.49,;5.69,-.51,;6.46,-1.84,;8,-1.84,;8.77,-.51,;10.31,-.51,;11.08,-1.84,;12.62,-1.84,;10.31,-3.18,;8.77,-3.18,;5.69,-3.18,;6.46,-4.51,;5.69,-5.84,;6.46,-7.18,;8,-7.18,;8.77,-5.84,;8.77,-8.51,;4.15,-5.84,;3.38,-7.18,;4.15,-8.51,;3.38,-4.51,;4.15,-3.18,;3.38,-1.84,;4.15,-.51,;3.38,.83,;8,6.16,;6.46,6.16,;8.77,7.49,)|
COc1cc2CC(=O)N(C3CCC(CC3)N(C3CCOCC3)C(C)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;8,-4.62,;8,-3.08,;6.67,-2.31,;9.34,-5.39,;10.67,-4.62,;12,-5.39,;13.34,-4.62,;13.34,-3.08,;12,-2.31,;10.67,-3.08,;9.34,-6.93,;10.67,-7.7,;8,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)N(CCCO)C(C)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(.87,15.85,;2.41,15.85,;3.18,14.52,;4.72,14.52,;5.49,13.19,;7.03,13.19,;7.8,11.85,;9.34,11.85,;7.03,10.52,;7.8,9.18,;7.03,7.85,;7.8,6.52,;9.34,6.52,;10.11,7.85,;9.34,9.18,;10.11,5.18,;11.65,5.18,;12.42,3.85,;13.96,3.85,;14.73,2.52,;9.34,3.85,;10.11,2.52,;7.8,3.85,;5.49,10.52,;4.72,9.18,;5.49,7.85,;4.72,6.52,;3.18,6.52,;2.41,5.18,;2.41,7.85,;3.18,9.18,;4.72,11.85,;3.18,11.85,;2.41,13.19,;.87,13.19,;.1,11.85,;.87,10.52,;-1.44,11.85,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)=O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-4.62,;9.34,-6.93,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)(C)O)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-6.16,;8.57,-6.72,;10.11,-4.06,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(O)C3CCOCC3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;9.34,-6.93,;10.67,-4.62,;12,-5.39,;13.34,-4.62,;13.34,-3.08,;12,-2.31,;10.67,-3.08,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(=O)C3CCOCC3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-4.62,;9.34,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;10.67,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(=O)C3CCOCC3)[C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C |wU:23.25,(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-4.62,;9.34,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;10.67,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(=O)C3CCOCC3)[C@H](c3ccc(Cl)cc3)c2cc1OC(C)C |wD:23.25,(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-4.62,;9.34,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;10.67,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)(O)C3CCOCC3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;10.67,-7.7,;12,-8.47,;13.34,-7.7,;13.34,-6.16,;12,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)[C@@](C)(O)C3CCOCC3)[C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C |wU:15.18,24.26,wD:15.17,(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;10.67,-7.7,;12,-8.47,;13.34,-7.7,;13.34,-6.16,;12,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)[C@](C)(O)C3CCOCC3)[C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C |wU:15.17,24.26,wD:15.18,(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;10.67,-7.7,;12,-8.47,;13.34,-7.7,;13.34,-6.16,;12,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(O)c3cccc(F)c3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-4.62,;9.34,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;12,-10.01,;10.67,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(=O)c3cccc(F)c3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;10.67,-4.62,;9.34,-6.93,;8,-7.7,;8,-9.24,;9.34,-10.01,;10.67,-9.24,;12,-10.01,;10.67,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)(O)c3cccc(F)c3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;10.67,-7.7,;12,-8.47,;13.34,-7.7,;13.34,-6.16,;14.67,-5.39,;12,-5.39,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
CCC(O)(C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O)c1cccc(F)c1 |(7.03,-6.72,;8.57,-6.72,;9.34,-5.39,;10.11,-4.06,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,;-1.33,-.77,;-2.67,,;-4,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;10.67,-6.16,;10.67,-7.7,;12,-8.47,;13.34,-7.7,;13.34,-6.16,;14.67,-5.39,;12,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)(O)CC(C)C)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;10.67,-7.7,;12,-8.47,;9.34,-8.47,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
CCCCC(C)(O)C1CCC(CC1)N1C(c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O |(14.67,-5.39,;13.34,-6.16,;12,-5.39,;10.67,-6.16,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;8,-4.62,;8,-3.08,;6.67,-2.31,;5.33,-3.08,;5.33,-4.62,;6.67,-5.39,;4,-2.31,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,;-1.33,-.77,;-2.67,,;-4,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)(O)CCC(C)C)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;12,-5.39,;13.34,-6.16,;14.67,-5.39,;13.34,-7.7,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
COc1cc2CC(=O)N(C3CCC(CC3)C(C)(O)c3ccoc3)C(c3ccc(Cl)cc3)c2cc1OC(C)C |(-4,-.77,;-2.67,,;-1.33,-.77,;;1.33,-.77,;2.67,,;4,-.77,;5.33,,;4,-2.31,;5.33,-3.08,;6.67,-2.31,;8,-3.08,;8,-4.62,;6.67,-5.39,;5.33,-4.62,;9.34,-5.39,;8.57,-6.72,;10.11,-4.06,;10.67,-6.16,;12.08,-5.53,;13.11,-6.68,;12.34,-8.01,;10.83,-7.69,;2.67,-3.08,;2.67,-4.62,;4,-5.39,;4,-6.93,;2.67,-7.7,;2.67,-9.24,;1.33,-6.93,;1.33,-5.39,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;-4,-5.39,)|
CC(C)c1c2C(N(C(=O)c2nn1Cc1ccccn1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1cccnc1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCc1c[nH]cn1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)CCn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1Cc1cc(=O)[nH]c2ccccc12)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1cc(=O)[nH]c2c(cnn12)C#N)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
[#6]-[#6](-[#6])-c1c2-[#6](-[#7](-[#6](=O)-c2nn1-[#6]\[#6]=[#6](\[#6])-[#6])-c1cccc(Cl)c1F)-c1ccc(Cl)cc1-[#6]
CC(C)c1c2C(N(C(=O)c2nn1CCc1ccccn1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCc1c[nH]c2ccccc12)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCN1C(=O)c2ccccc2C1=O)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)CCn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(F)cc1)c1cccc(Cl)c1F
CC(C)CCn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(F)c(F)c1)c1cccc(Cl)c1F
CCN1CCN(CCn2nc3C(=O)N(C(c3c2C(C)C)c2ccc(Cl)cc2)c2cccc(Cl)c2F)C1=O
CC(C)c1c2C(N(C(=O)c2nn1C1CCN(C1)C(=O)OC(C)(C)C)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1cc(C)nn1C)c1cccc(Cl)c1F)c1ccc(Cl)cc1
CC(C)c1c2C(N(C(=O)c2nn1Cc1ncc[nH]1)c1cccc(Cl)c1F)c1ccc(Cl)cc1
CC(C)c1c2C(N(C(=O)c2nn1Cc1nnn[nH]1)c1cccc(Cl)c1F)c1ccc(Cl)cc1
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)N1CCC(O)CC1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)N1CCC(CCO)CC1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)NC1CCN(CC1)C(C)=O)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)N1CCN(CC1)C(C)=O)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)N1CCNC(=O)C1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)N1CCN(C)C(=O)C1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC1CCN(CC1)C(C)=O)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)NC(=O)N1CCC(Cn2nc3C(=O)N(C(c3c2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)CC1
CC(C)c1c2C(N(C(=O)c2nn1CC=C)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(O)CO)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC1(O)CCN(CC1)C(C)=O)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)NC(=O)N1CCC(O)(Cn2nc3C(=O)N(C(c3c2C(C)C)c2ccc(Cl)cc2C)c2cc(Cl)ccc2C)CC1
CC(C)c1c2C(N(C(=O)c2nn1CCc1ccccc1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCN(C)C)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1ccccc1C#N)c1ccc(F)c(F)c1)c1ccc(Cl)cc1
CC(C)c1c2C(N(C(=O)c2nn1Cc1csc(C)n1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
COCCn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1Cc1ccncc1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1cscn1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
COCCn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1ccccn1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CNC(=O)Cn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
CC(C)CCn1nc2C(=O)N(C(c2c1C1CC1)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1CCCO)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(=O)N1CCCC1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC1CCCO1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCN1CCN(C)CC1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC(C)(C)O)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CCn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1OCCN(C)C
CC(C)c1c2C(N(C(=O)c2nn1CCN1CCCC1=O)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1ccccc1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1C(=O)N1CCN(C)CC1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1C(=O)N(C)c1ccccc1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
COC(=O)N1CCCC1Cn1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
CC(C)c1c2C(N(C(=O)c2nn1CC1CCCN1C(=O)N(C)C)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC1CCCN1C(C)=O)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1Cc1ccccc1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CC1CCCCC1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCO)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1-c1ccc(cc1)C#N)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1-c1ccccc1F)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCO)c1cccc(Cl)c1F)c1ccc(Cl)cc1Cl
CNS(=O)(=O)Cc1ccc(cc1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1C1CCN(C)CC1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1-c1ccc(Cl)cc1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1-c1ccc(cc1)C(N)=O)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCO)c1cccc(Cl)c1F)c1ccc(Cl)c(F)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(F)cc1)c1cccc(Cl)c1F
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(F)c(F)c1)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1-c1ccncc1)c1cccc(Cl)c1F)c1ccc(Cl)cc1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(C)cc1)c1cccc(Cl)c1F
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1-c1cc(=O)n(C)c(=O)n1C)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1C1CCN(C)CC1)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1C1CCOCC1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
COc1ccccc1-n1nc2C(=O)N(c3cccc(Cl)c3F)C(CC(=O)N3CCOCC3)(c2c1C(C)C)c1ccc(Cl)cc1
CC(C)c1c2C(N(C(=O)c2nn1-c1ccccc1Cl)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1-c1ccc(F)cc1F)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCC#N)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCO)c1ccc(F)c(Cl)c1)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1-c1ccc(cc1C)C#N)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
Cc1cc(Cl)ccc1C1N(C(=O)c2nn(CCO)c(C3CCC3)c12)c1cccc(Cl)c1F
CC(C)c1c2C(N(C(=O)c2nn1-c1cccc(c1)C#N)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1CCO)c1cc(Cl)ccc1C)c1ccc(Cl)cc1C
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
Cc1cc(Cl)ccc1C1N(C(=O)c2nn(CCO)c(C3CC3)c12)c1cccc(Cl)c1F
COc1ccccc1-n1nc2C(=O)N(C(c2c1C1CC1)c1ccc(Cl)cc1C)c1cccc(Cl)c1F
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(F)cc1F
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(Cl)c1
COC(=O)CCC1(N(C(=O)c2nn(c(C(C)C)c12)-c1ccccc1OC)c1ccc(F)c(Cl)c1)c1ccc(Cl)cc1
CCOC(=O)C1(N(C(=O)c2nn(c(C(C)C)c12)-c1ccccc1OC)c1ccc(F)c(Cl)c1)c1ccc(Cl)cc1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cncc(Cl)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1OCCN(C)C
COc1ccccc1-n1nc2C(=O)N(c3ccc(F)c(Cl)c3)C(C)(c2c1C(C)C)c1ccc(Cl)cc1
COCCCOc1cc(Cl)ccc1C1(C)N(C(=O)c2nn(c(C(C)C)c12)-c1ccccc1OC)c1cccc(Cl)c1F
COc1ccccc1-n1nc2C(=O)N(c3ccc(F)c(Cl)c3)C(CC(O)CN3CCCC3)(c2c1C(C)C)c1ccc(Cl)cc1
CNC(=O)c1ccc(C)c(c1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C(F)(F)F)c1cc(Cl)ccc1C
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cn1)c1ccc(F)c(Cl)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cn1)c1cc(Cl)ccc1C
COc1ccccc1-n1nc2C(=O)N(c3ccc(F)c(Cl)c3)C(CC(O)CO)(c2c1C(C)C)c1ccc(Cl)cc1
COc1ccccc1-n1nc2C(=O)N(c3ccc(F)c(Cl)c3)C(CCO)(c2c1C(C)C)c1ccc(Cl)cc1
CNC(=O)c1ccc(OC)c(c1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)NCCN1CCCC1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)cc(c1)[N+]#[C-]
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)cc(c1)C(N)=O
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)cc(NC(C)=O)c1
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C(=O)N(C)C
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1ccc(F)c(F)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1
CCn1cc(cc(Cl)c1=O)N1C(c2c(nn(c2C(C)C)-c2ccccc2OC)C1=O)c1ccc(Cl)cc1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(CCO)c1
COCCn1cc(cc(Cl)c1=O)N1C(c2c(nn(c2C(C)C)-c2ccccc2OC)C1=O)c1ccc(Cl)cc1C
CCn1cc(cc(Cl)c1=O)N1C(c2c(nn(c2C(C)C)-c2ccccc2OC)C1=O)c1ccc(Cl)cc1C
CNC(=O)c1ccc(OC)c(c1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(CCN(C)C)c1
CC(C)c1c2C(N(C(=O)c2nn1C1CC1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C
CC(C)c1c2C(N(C(=O)c2nn1C1CCC(O)CC1)c1cccc(Cl)c1F)c1ccc(Cl)cc1C |(1.6,-3.66,;.26,-2.89,;-1.07,-3.66,;.26,-1.35,;-.98,-.44,;-2.52,-.44,;-3,1.02,;-1.75,1.93,;-1.75,3.47,;-.51,1.02,;1.03,1.02,;1.51,-.44,;3,-.84,;3.4,-2.33,;4.88,-2.73,;5.97,-1.64,;7.46,-2.03,;5.57,-.15,;4.09,.25,;-4.49,1.42,;-5.57,.33,;-7.06,.73,;-7.46,2.22,;-6.37,3.31,;-6.77,4.8,;-4.88,2.91,;-3.79,4,;-3.61,-1.53,;-3.21,-3.02,;-4.3,-4.11,;-5.79,-3.71,;-6.88,-4.8,;-6.19,-2.22,;-5.1,-1.13,;-5.87,.2,)|
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1ccnc(Cl)c1
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ncc1OC
CC(C)c1c2C(N(C(=O)c2nn1-c1cn[nH]c1)c1cccc(Cl)c1F)c1ccc(Cl)cc1
COc1ccncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1ccncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
CC(C)(C)c1[nH]nc2C(=O)N(C(c12)c1ccc(Cl)cc1)c1cccc(Cl)c1F
COc1ccccc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)ccc1OCc1nn[nH]n1
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C#N
COc1ccc(CN)cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
CC(C)c1c2[C@@H](N(C(=O)c2nn1CCO)c1cccc(Cl)c1F)c1ccc(Cl)cc1C |r|
CC(C)c1c2[C@H](N(C(=O)c2nn1CCO)c1cccc(Cl)c1F)c1ccc(Cl)cc1C |r|
COc1ccccc1-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |r|
COc1ccccc1-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |r|
COc1ccccc1-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1OCCN(C)C |r|
COc1ccccc1-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1OCCN(C)C |r|
COc1ncc(c(OC)n1)-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1 |r|
COc1nc(ncc1-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O)N(C)C |r|
COc1ccc(CNC(C)=O)cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(CNC=O)cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1)C#N
COc1ccc(CN)cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1
COc1ccc(CNC(C)=O)cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C
COc1cnc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C)C#N
COc1cnc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1)C#N
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)[N+]#[C-])c1cc(Cl)ccc1C)C#N
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1C)[N+]#[C-])c1cc(Cl)c(=O)n(C)c1)C#N
COc1ccc(cc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1C)[N+]#[C-])c1cc(Cl)ccc1C)C#N
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)cn(C)c1=O
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c(=O)n(C)c1)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O)N(C)C
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1 |r|
COc1ncc(c(OC)n1)-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)c(=O)n(C)c1 |r|
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1c[nH]c(=O)c(Cl)c1
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1c[nH]c(=O)c(Cl)c1)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c[nH]c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1c[nH]c(=O)c(Cl)c1)N(C)C
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1c[nH]c(=O)c(Cl)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c[nH]c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c(=O)n(C)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)cn(C)c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1c[nH]c(=O)c(Cl)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O |r|
COc1ncc(c(OC)n1)-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O |r|
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O
COc1nc(ncc1-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O)N(C)C |r|
COc1nc(ncc1-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)cn(C)c1=O)N(C)C |r|
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c[nH]c1=O
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c(=O)n(C)c1
CNc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1)C#N)c1c[nH]c(=O)c(Cl)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c(=O)n(C)c1 |r|
COc1nc(ncc1-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c(=O)n(C)c1)N(C)C |r|
COc1nc(ncc1-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c(=O)n(C)c1)N(C)C |r|
COc1nc(ncc1-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(Cl)cc1)c1cc(Cl)c[nH]c1=O)N(C)C |r|
COc1nc(ncc1-n1nc2C(=O)N([C@@H](c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c[nH]c1=O)N(C)C |r|
COc1nc(ncc1-n1nc2C(=O)N([C@H](c2c1C(C)C)c1ccc(cc1)C#N)c1cc(Cl)c[nH]c1=O)N(C)C |r|
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1F)c1cc(Cl)c(=O)n(C)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1F)c1cc(Cl)cn(C)c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)c(=O)n(C)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)cn(C)c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1F)[N+]#[C-])c1cc(Cl)c(=O)n(C)c1
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc([N+]#[C-])c(F)c1)c1cc(Cl)cn(C)c1=O
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(cc1F)[N+]#[C-])c1cc(Cl)cn(C)c1=O
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(C#N)c(F)c1)c1cc(Cl)cn(C)c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(C#N)c(F)c1)c1cc(Cl)c(=O)n(C)c1)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(C#N)c(F)c1)c1cc(Cl)c[nH]c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(C#N)c(F)c1)c1c[nH]c(=O)c(Cl)c1)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)cn(C)c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)c[nH]c1=O)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)c(F)c1)c1cc(Cl)c(=O)n(C)c1)N(C)C
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)c(F)c1)c1c[nH]c(=O)c(Cl)c1)N(C)C
COc1ncc(c(OC)n1)-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(C)cn(C)c1=O
COc1nc(ncc1-n1nc2C(=O)N(C(c2c1C(C)C)c1ccc(Cl)cc1)c1cc(C)cn(C)c1=O)N(C)C
CC(C)c1ccnc(c1)-c1nc2cc(nc(N[C@H](C)C3CCC3)c2n1C[C@H]1CC[C@H](C)CC1)C(O)=O |r,wU:26.29,17.18,wD:29.33,(4.62,5.78,;5.39,4.45,;6.93,4.45,;4.62,3.12,;5.39,1.78,;4.62,.45,;3.08,.45,;2.31,1.78,;3.08,3.12,;.77,1.78,;-.13,3.03,;-1.6,2.55,;-2.93,3.32,;-4.26,2.55,;-4.26,1.01,;-2.93,.24,;-2.93,-1.3,;-4.26,-2.07,;-5.6,-1.3,;-4.26,-3.61,;-5.35,-4.7,;-4.26,-5.78,;-3.18,-4.7,;-1.6,1.01,;-.13,.54,;.27,-.95,;1.75,-1.35,;2.84,-.26,;4.33,-.66,;4.73,-2.15,;6.22,-2.54,;3.64,-3.23,;2.15,-2.84,;-5.6,3.32,;-6.93,2.55,;-5.6,4.86,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCC[C@H]2c2nccs2)CC1 |r,wU:1.0,wD:32.37,4.4,(7.09,-3.78,;5.6,-3.38,;4.52,-4.47,;3.03,-4.08,;2.63,-2.59,;1.14,-2.19,;.74,-.7,;1.65,.54,;.74,1.79,;-.72,1.31,;-2.05,2.08,;-3.39,1.31,;-3.39,-.23,;-2.05,-1,;-2.05,-2.54,;-.72,-3.31,;-.72,-4.85,;-2.05,-5.62,;-3.39,-4.85,;-4.72,-5.62,;-3.39,-3.31,;-.72,-.23,;-4.72,2.08,;-6.19,1.61,;-7.09,2.85,;-6.19,4.1,;-6.96,5.43,;-4.72,3.62,;3.19,.54,;4.09,-.7,;5.56,-.23,;5.56,1.31,;4.09,1.79,;3.32,3.12,;1.86,3.6,;1.86,5.14,;3.32,5.62,;4.23,4.37,;3.72,-1.5,;5.21,-1.9,)|
CC(C)[C@@H]1C[C@@H](O)CN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:26.29,5.5,wD:3.2,29.33,(4.19,4.55,;3.42,3.21,;1.94,3.61,;4.19,1.88,;5.66,1.41,;5.66,-.13,;6.99,-.9,;4.19,-.61,;3.29,.64,;1.75,.64,;.84,1.88,;-.62,1.41,;-1.95,2.18,;-3.29,1.41,;-3.29,-.13,;-1.95,-.9,;-1.95,-2.44,;-.62,-3.21,;-.62,-4.75,;-1.95,-5.52,;-3.29,-4.75,;-4.62,-5.52,;-3.29,-3.21,;-.62,-.13,;.84,-.61,;.84,-2.15,;2.18,-2.92,;3.51,-2.15,;4.84,-2.92,;4.84,-4.46,;6.18,-5.23,;3.51,-5.23,;2.18,-4.46,;-4.62,2.18,;-6.09,1.7,;-6.99,2.95,;-6.09,4.19,;-6.86,5.52,;-4.62,3.72,)|
CO[C@H]1COC[C@@H]1N(C)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1CC1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:6.7,wD:2.1,29.33,(7.45,.64,;5.91,.64,;5.14,1.97,;5.62,3.43,;4.37,4.34,;3.12,3.43,;3.6,1.97,;2.83,.64,;3.6,-.7,;1.29,.64,;.39,1.88,;-1.08,1.41,;-2.41,2.18,;-3.75,1.41,;-3.75,-.13,;-2.41,-.9,;-2.41,-2.44,;-1.08,-3.21,;-1.08,-4.75,;-2.41,-5.52,;-3.75,-4.75,;-5.08,-5.52,;-3.75,-3.21,;-1.08,-.13,;.39,-.61,;.78,-2.1,;2.27,-2.5,;3.36,-1.41,;4.85,-1.81,;5.25,-3.29,;6.73,-3.69,;4.16,-4.38,;2.67,-3.98,;-5.08,2.18,;-6.55,1.7,;-7.45,2.95,;-6.55,4.19,;-7.32,5.52,;-5.08,3.72,)|
CCN(C)C(=O)[C@@H]1CCCN1c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1noc(=O)[nH]1 |r,wU:31.35,wD:6.5,28.31,(7.23,4.94,;6.14,3.85,;4.65,4.25,;4.25,5.73,;3.56,3.16,;2.07,3.56,;3.96,1.67,;5.42,1.2,;5.42,-.34,;3.96,-.82,;3.05,.43,;1.51,.43,;.61,1.67,;-.86,1.2,;-2.19,1.97,;-3.52,1.2,;-3.52,-.34,;-2.19,-1.11,;-2.19,-2.65,;-.86,-3.42,;-.86,-4.96,;-2.19,-5.73,;-3.52,-4.96,;-4.86,-5.73,;-3.52,-3.42,;-.86,-.34,;.61,-.82,;1.01,-2.31,;2.5,-2.71,;2.89,-4.19,;4.38,-4.59,;5.47,-3.5,;6.96,-3.9,;5.07,-2.02,;3.58,-1.62,;-4.86,1.97,;-6.32,1.49,;-7.23,2.74,;-6.32,3.98,;-7.09,5.31,;-4.86,3.51,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CN(CC[C@@H]23)C(=O)OCc2ccccc2)CC1 |r,wU:32.35,4.4,wD:37.41,1.0,(3.02,-6.79,;1.69,-6.02,;1.69,-4.48,;.36,-3.71,;-.98,-4.48,;-2.31,-3.71,;-2.31,-2.17,;-1.4,-.92,;-2.31,.32,;-3.77,-.15,;-5.11,.62,;-6.44,-.15,;-6.44,-1.69,;-5.11,-2.46,;-5.11,-4,;-3.77,-4.77,;-3.77,-6.31,;-5.11,-7.08,;-6.44,-6.31,;-7.78,-7.08,;-6.44,-4.77,;-3.77,-1.69,;-7.78,.62,;-9.24,.14,;-10.15,1.39,;-9.24,2.63,;-10.01,3.97,;-7.78,2.16,;.14,-.92,;.91,-2.25,;2.45,-2.25,;3.22,-.92,;2.45,.41,;3.22,1.75,;2.45,3.08,;.91,3.08,;.14,1.75,;.91,.41,;3.22,4.41,;2.45,5.75,;4.76,4.41,;5.53,5.75,;7.07,5.75,;7.84,4.41,;9.38,4.41,;10.15,5.75,;9.38,7.08,;7.84,7.08,;-.98,-6.02,;.36,-6.79,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CNCC[C@@H]23)CC1 |r,wU:32.35,4.4,wD:37.41,1.0,(6.49,-5.23,;5.16,-4.46,;5.16,-2.92,;3.82,-2.15,;2.49,-2.92,;1.16,-2.15,;1.16,-.61,;2.06,.64,;1.16,1.88,;-.31,1.41,;-1.64,2.18,;-2.98,1.41,;-2.98,-.13,;-1.64,-.9,;-1.64,-2.44,;-.31,-3.21,;-.31,-4.75,;-1.64,-5.52,;-2.98,-4.75,;-4.31,-5.52,;-2.98,-3.21,;-.31,-.13,;-4.31,2.18,;-5.78,1.7,;-6.68,2.95,;-5.78,4.19,;-6.55,5.52,;-4.31,3.72,;3.6,.64,;4.37,-.7,;5.91,-.7,;6.68,.64,;5.91,1.97,;6.68,3.3,;5.91,4.64,;4.37,4.64,;3.6,3.3,;4.37,1.97,;2.49,-4.46,;3.82,-5.23,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2CCO[C@@H]3CN(Cc4ccccc4)CC[C@@H]23)CC1 |r,wU:32.35,4.4,wD:44.49,1.0,(4.18,-6.12,;2.85,-5.35,;2.85,-3.81,;1.51,-3.04,;.18,-3.81,;-1.15,-3.04,;-1.15,-1.5,;-.25,-.25,;-1.15,.99,;-2.62,.52,;-3.95,1.29,;-5.29,.52,;-5.29,-1.02,;-3.95,-1.79,;-3.95,-3.33,;-2.62,-4.1,;-2.62,-5.64,;-3.95,-6.41,;-5.29,-5.64,;-6.62,-6.41,;-5.29,-4.1,;-2.62,-1.02,;-6.62,1.29,;-8.09,.81,;-8.99,2.06,;-8.09,3.3,;-8.86,4.64,;-6.62,2.83,;1.29,-.25,;2.06,-1.59,;3.6,-1.59,;4.37,-.25,;3.6,1.08,;4.37,2.41,;3.6,3.75,;4.37,5.08,;5.91,5.08,;6.68,3.75,;8.22,3.75,;8.99,5.08,;8.22,6.41,;6.68,6.41,;2.06,3.75,;1.29,2.41,;2.06,1.08,;.18,-5.35,;1.51,-6.12,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2noc(=O)[nH]2)N2[C@H](C)CN(C[C@H]2C)C(C)=O)CC1 |r,wU:4.4,34.39,wD:1.0,29.33,(6.97,-4.31,;5.48,-3.92,;5.08,-2.43,;3.6,-2.03,;2.51,-3.12,;1.02,-2.72,;0,-.61,;.91,.64,;0,1.88,;-1.46,1.41,;-2.8,2.18,;-4.13,1.41,;-4.13,-.13,;-2.8,-.9,;-2.8,-2.44,;-1.46,-3.21,;-1.46,-4.75,;-2.8,-5.52,;-4.13,-4.75,;-5.47,-5.52,;-4.13,-3.21,;-1.46,-.13,;-5.47,2.18,;-6.93,1.7,;-7.84,2.95,;-6.93,4.19,;-7.7,5.52,;-5.47,3.72,;2.45,.64,;3.22,1.97,;2.45,3.3,;4.76,1.97,;5.53,.64,;4.76,-.7,;3.22,-.7,;2.45,-2.03,;7.07,.64,;7.84,-.7,;7.84,1.97,;2.91,-4.61,;4.39,-5.01,)|
CCOC(C1CCCC1)c1nc2cc(nc(-c3cncc(Cl)c3)c2n1C[C@H]1CC[C@H](C)CC1)-c1n[nH]c(=O)[nH]1 |r,wU:26.29,wD:29.33,(5.29,6.14,;4.52,4.81,;5.29,3.48,;4.52,2.14,;5.29,.81,;4.81,-.66,;6.06,-1.56,;7.3,-.66,;6.83,.81,;2.98,2.14,;2.07,3.39,;.61,2.91,;-.73,3.68,;-2.06,2.91,;-2.06,1.37,;-.73,.6,;-.73,-.94,;.61,-1.71,;.61,-3.25,;-.73,-4.02,;-2.06,-3.25,;-3.39,-4.02,;-2.06,-1.71,;.61,1.37,;2.07,.9,;3.78,-.19,;3.38,-1.68,;4.47,-2.77,;4.08,-4.26,;2.59,-4.66,;2.19,-6.14,;1.5,-3.57,;1.9,-2.08,;-3.39,3.68,;-3.39,5.22,;-4.86,5.7,;-5.76,4.45,;-7.3,4.45,;-4.86,3.21,)|
CCOC(=O)c1cc2nc(N3CCOC[C@H]3c3ccccc3)n(C[C@H]3CC[C@H](C)CC3)c2c(n1)-c1cncc(Cl)c1 |r,wU:24.25,wD:15.16,27.29,(-7.5,.95,;-6.16,1.72,;-4.83,.95,;-3.49,1.72,;-3.49,3.26,;-2.16,.95,;-.83,1.72,;.51,.95,;1.97,1.43,;2.88,.18,;4.42,.18,;5.19,-1.15,;6.73,-1.15,;7.5,.18,;6.73,1.52,;5.19,1.52,;4.79,3,;3.3,3.4,;2.9,4.89,;3.99,5.98,;5.48,5.58,;5.88,4.09,;1.97,-1.06,;1.97,-2.6,;3.3,-3.37,;4.64,-2.6,;5.97,-3.37,;5.97,-4.91,;7.31,-5.68,;4.64,-5.68,;3.3,-4.91,;.51,-.59,;-.83,-1.36,;-2.16,-.59,;-.83,-2.9,;.51,-3.67,;.51,-5.21,;-.83,-5.98,;-2.16,-5.21,;-3.49,-5.98,;-2.16,-3.67,)|
C[C@H]1CC[C@H](Cn2c(nc3cc(nc(-c4cncc(Cl)c4)c23)-c2cccc(=O)[nH]2)N2CCOC[C@H]2c2ccccc2)CC1 |r,wU:4.4,wD:1.0,34.39,(7.31,-5.45,;5.97,-4.68,;5.97,-3.14,;4.64,-2.37,;3.3,-3.14,;1.97,-2.37,;1.97,-.83,;2.88,.41,;1.97,1.66,;.51,1.18,;-.83,1.95,;-2.16,1.18,;-2.16,-.36,;-.83,-1.13,;-.83,-2.67,;.51,-3.44,;.51,-4.98,;-.83,-5.75,;-2.16,-4.98,;-3.49,-5.75,;-2.16,-3.44,;.51,-.36,;-3.49,1.95,;-3.49,3.49,;-4.83,4.26,;-6.16,3.49,;-6.16,1.95,;-7.5,1.18,;-4.83,1.18,;4.42,.41,;5.19,-.92,;6.73,-.92,;7.5,.41,;6.73,1.75,;5.19,1.75,;4.42,3.08,;5.19,4.41,;4.42,5.75,;2.88,5.75,;2.11,4.41,;2.88,3.08,;3.3,-4.68,;4.64,-5.45,)|
CCN(C(C)C)C(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOP(=O)(OC(C)(C)C)OC(C)(C)C |r|
COCCN(CCOC)C(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)N1CCN(C)CC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(C)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)C(C)C |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(C)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)OC1CCCCC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)OC(C)C |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)N1CCOCC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)O[C@@H](C)OC(=O)N1CCOCC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)O[C@H](C)OC(=O)N1CCOCC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)N1CCN(CC1)C(=O)OC(C)(C)C |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)N1CCNCC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)N1CCS(=O)(=O)CC1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NCC1COC(C)(C)O1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NCC(O)CO |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NC1CCOCC1 |r|
COCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOCCOCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r,Sg:n:4,3,2::ht|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NCC(=O)OCc1ccccc1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)NCC(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)NCC(=O)OCc1ccccc1.COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 |r,$;;;;;;;;;;;;HN;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;$|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)NCC(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
COCCOCCOCCOC(=O)OC(OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1)C(C)C |r|
COCCOCCOCCOC(=O)OCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOCCOCCOCCOC(=O)OCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOC(=O)OCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r,Sg:n:3,2,4::ht|
COCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r,Sg:n:3,2,4::ht|
COCCOCCOCCOCCOCCOCCOC(=O)OCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOCCOCCOCCOCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCOCCOCCOCCOCCOCCOC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
COCCOCCNC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r,Sg:n:3,2,4::ht|
COCCOCCNC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r,Sg:n:4,3,2::ht|
COCCOCCNC(=O)OCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r,Sg:n:4,3,2::ht|
COc1cc(ccc1NC(=O)[C@@H]1NC(CC(C)(C)C)[C@@](C#N)(C1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)N[C@@H](C)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)OCCOCCOCCOCCOP(=O)(OCc1ccccc1)OCc1ccccc1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOC(=O)OCCOCCOCCOCCOP(O)(O)=O |r|
OC(=O)C(F)(F)F.COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OCOP(O)(O)=O |r|
[H][C@@]1(COC(C)(C)O1)[C@@]1([H])C[C@]2([H])OC(C)(C)O[C@]2([H])[C@H]1OC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1 |r|
[H][C@@]1(O[C@H](O)[C@H](O)[C@H]1OC(=O)OC(C)OC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)c(OC)c1)[C@H](O)CO |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)OCCOCCOCCOCCOP(=O)(OCc1ccccc1)OCc1ccccc1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(=O)OC(C)OC(=O)OCCOCCOCCOCCOP(O)(O)=O |r|
COc1ccc(cc1O)C(Nc1cc(C)ccn1)c1ccc2cccnc2c1O
Oc1c(ccc2cccnc12)C(Nc1cccnc1)c1cccs1
Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1ccc(Cl)cc1Cl
Cc1ccsc1C(Nc1cc(C)ccn1)c1ccc2cccnc2c1O
Cc1cccc(NC(c2ccc(OC(F)(F)F)cc2)c2ccc3cccnc3c2O)n1
Cc1cccc(NC(c2cccc(c2)C(F)(F)F)c2ccc3cccnc3c2O)n1
Cc1cccc(NC(c2cccc(Cl)c2Cl)c2ccc3cccnc3c2O)n1
Cc1ccnc(NC(c2cccc(Cl)c2Cl)c2ccc3cccnc3c2O)c1
Cc1ccnc(NC(c2ccccc2Cl)c2ccc3cccnc3c2O)c1
COc1ccc(cc1O)C(Nc1cccc(C)n1)c1ccc2cccnc2c1O
Oc1c(ccc2cccnc12)C(Nc1ccccn1)c1cc(Cl)ccc1Cl
Cc1ccnc(NC(c2ccc(Cl)c(Cl)c2)c2ccc3cccnc3c2O)c1
Cc1cccc(NC(c2ccc3cccnc3c2O)c2c(F)c(F)cc(F)c2F)n1
Oc1c(ccc2cccnc12)C(Nc1ccc(Cl)cn1)c1ccc(cc1)C(F)(F)F
Oc1c(ccc2cccnc12)C(Nc1ccc(Cl)cn1)c1ccc(Cl)c(Cl)c1
Cc1cc(Cl)cnc1NC(c1ccc2cccnc2c1O)c1cc(ccc1Cl)C(F)(F)F
Oc1c(ccc2cccnc12)C(Nc1ccc(nc1)C(F)(F)F)c1cc(ccc1Cl)C(F)(F)F
Oc1c(ccc2cccnc12)C(Nc1ccc(Cl)cn1)c1ccc(Cl)c(c1)C(F)(F)F
Oc1c(ccc2cccnc12)C(Nc1ccc(F)cn1)c1c(F)c(F)cc(F)c1F
Cc1cccc(NC(c2ccc(Cl)c(Cl)c2)c2ccc3ccc(C)nc3c2O)n1
Cc1cccc(NC(c2ccc3ccc(C)nc3c2O)c2c(Cl)cccc2Cl)n1
Oc1c(ccc2cccnc12)C(Nc1ccc(F)cn1)c1ccc(F)cc1Cl
Cc1ccc2ccc(C(Nc3cccnc3)c3c(F)c(F)c(OCC(F)(F)F)c(F)c3F)c(O)c2n1
Oc1c(ccc2cccnc12)C(Nc1ccc(F)cn1)c1ccc(Cl)c(Cl)c1
Cc1cc(NC(c2ccccc2Cl)c2ccc3cccnc3c2O)ncc1F
Cc1cc(NC(c2ccc3cccnc3c2O)c2cc(Cl)ccc2Cl)ncc1F
COc1ccc(cc1OC)C(Nc1ncc(Cl)cc1C)c1ccc2cccnc2c1O
COc1ccc(cc1OC)C(Nc1cc(C)c(Cl)cn1)c1ccc2cccnc2c1O
COc1ccc(cc1OC)C(Nc1cc(Cl)c(Cl)cn1)c1ccc2cccnc2c1O
COc1ccc(C(Nc2cc(C)c(Cl)cn2)c2ccc3cccnc3c2O)c(OC)c1OC
COc1ccc(C(Nc2cc(Cl)c(Cl)cn2)c2ccc3cccnc3c2O)c(OC)c1OC
Cc1nc(NC(c2ccc(Cl)c(Cl)c2)c2ccc3cccnc3c2O)c(Cl)cc1Cl
COc1ccc(C(Nc2ncc(Cl)cc2C)c2ccc3cccnc3c2O)c(OC)c1OC
COc1ccc(C(Nc2nc(C)c(Cl)cc2Cl)c2ccc3cccnc3c2O)c(OC)c1OC
COc1ccc(C(Nc2ncc(Cl)cc2OC)c2ccc3cccnc3c2O)c(OC)c1OC
CCc1c(Cl)cnc(NC(c2ccc3cccnc3c2O)c2ccc(OC)c(OC)c2OC)c1F
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1NC(N)=O |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1NC(=O)NC |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1NC(C)=O |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1N(C)C |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1C(N)=O |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1CO |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1CN |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1CNC(C)=O |r|
CCOc1cc2CC(=O)N(C(c3ccc(Cl)cc3)c2cc1OCC)c1ccc(C)cc1OCCCN1CCOCC1
CCOc1cc2CC(=O)N(C(c3ccc(Cl)cc3)c2cc1OCC)c1ccc(C)cc1OCC(O)=O
CCOc1cc2CC(=O)N(C(c3ccc(Cl)cc3)c2cc1OCC)c1ccc(C)cc1OCc1nn[nH]n1
CC[C@@H](C)Oc1cc2C(N(C(=O)Nc2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1 |r|
COc1ccc(cc1)N1C(c2ccc(Cl)cc2)c2cc(OC)c(OC)cc2NC1=O
CC[C@@H](C)Oc1cc2C(N(C(=O)N(C)c2cc1OC)c1ccc(cc1)N(C)C)c1ccc(Cl)cc1 |r|
COc1ccc(cc1)N1C(c2ccc(Cl)cc2)c2cc(OC)c(OCCN3CCOCC3)cc2CC1=O
COc1ccc(cc1)N1C(c2ccc(Cl)cc2)c2cc(OC)c(OCCN)cc2CC1=O
CCOc1cc2CC(=O)N(C(c3ccc(Cl)cc3)c2cc1O[C@H](C)CC)c1ccc(OC)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OCC(=O)N1CCN(C)CC1)c1ccc(OC)cc1)c1ccc(Cl)cc1 |r|
CCCOc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(OC)cc1)c1ccc(Cl)cc1
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(OC)cc1)c1ccc(Cl)cc1 |r|
COc1cc2CC(=O)N(C(c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C
CC(C)Nc1ccc2CC(=O)N(C(c3ccc(Cl)cc3)c2c1)c1ccc(cc1)N(C)Cc1ccncc1
CCC(=O)Nc1ccc2CC(=O)N(C(c3ccc(Cl)cc3)c2c1)c1ccc(cc1)N(C)Cc1ccncc1
CCCN(C(C)C)c1ccc2CC(=O)N(C(c3ccc(Cl)cc3)c2c1)c1ccc(cc1)N(C)Cc1ccncc1
CC(C)N(CCN(C)C)c1ccc2CC(=O)N(C(c3ccc(Cl)cc3)c2c1)c1ccc(cc1)N(C)Cc1ccncc1
CC(C)N(CCNC(C)=O)c1ccc2CC(=O)N(C(c3ccc(Cl)cc3)c2c1)c1ccc(cc1)N(C)Cc1ccncc1
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N1CCCC1=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)-n1cccn1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)-c1cn[nH]c1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(=O)N(C)CC)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(=O)N1C[C@H](O)C[C@H]1C(=O)NC)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(CO)cc1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)Cc1ccncc1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(CC1CCCC1)C(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)CC1CCCNC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)CC1CCCN(C)C1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)CC1CCNCC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)CC1CCN(CC1)C(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)CC1CCN(CC1)S(C)(=O)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)CC1CCN(CC1)C(=O)N(C)C)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C[C@H]1CC[C@H](N)CC1)c1ccc(Cl)cc1 |r,wU:27.29,wD:2.2,30.33,(9.34,1.54,;8,.77,;6.67,1.54,;6.67,3.08,;5.33,.77,;4,1.54,;2.67,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;1.33,3.08,;2.67,3.85,;4,3.08,;5.33,3.85,;5.33,5.39,;-2.67,.77,;-4,1.54,;-5.33,.77,;-5.33,-.77,;-4,-1.54,;-2.67,-.77,;-6.67,-1.54,;-6.67,-3.08,;-8,-.77,;-8,.77,;-9.34,1.54,;-9.34,3.08,;-8,3.85,;-8,5.39,;-6.67,3.08,;-6.67,1.54,;,-.77,;-1.33,-1.54,;-1.33,-3.08,;,-3.85,;,-5.39,;1.33,-3.08,;1.33,-1.54,)|
CCN[C@H]1CC[C@H](CN(C)c2ccc(cc2)N2C(c3ccc(Cl)cc3)c3cc(O[C@H](C)CC)c(OC)cc3CC2=O)CC1 |r,wU:6.6,wD:29.31,3.2,(-6.67,6.54,;-6.67,5,;-8,4.23,;-8,2.69,;-9.34,1.92,;-9.34,.38,;-8,-.39,;-8,-1.93,;-6.67,-2.7,;-6.67,-4.24,;-5.33,-1.93,;-5.33,-.39,;-4,.38,;-2.67,-.39,;-2.67,-1.93,;-4,-2.7,;-1.33,.38,;,-.38,;,-1.92,;-1.33,-2.7,;-1.33,-4.24,;,-5,;,-6.54,;1.33,-4.24,;1.33,-2.7,;1.33,.38,;2.67,-.38,;4,.38,;5.33,-.39,;6.67,.38,;6.67,1.92,;8,-.39,;9.34,.38,;4,1.92,;5.33,2.7,;5.33,4.24,;2.67,2.69,;1.33,1.92,;,2.69,;-1.33,1.92,;-2.67,2.7,;-6.67,.38,;-6.67,1.92,)|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N(C)CC)c1ccc(Cl)cc1 |r,wU:27.29,wD:30.36,2.2,(9.34,.38,;8,-.38,;6.67,.38,;6.67,1.93,;5.33,-.38,;4,.38,;2.67,-.38,;1.33,.38,;,-.38,;-1.33,.38,;-1.33,1.93,;-2.67,2.69,;,2.69,;1.33,1.93,;2.67,2.69,;4,1.93,;5.33,2.69,;5.33,4.23,;-2.67,-.38,;-4,.38,;-5.33,-.38,;-5.33,-1.93,;-4,-2.69,;-2.67,-1.93,;-6.67,-2.69,;-6.67,-4.23,;-8,-1.93,;-8,-.38,;-9.34,.38,;-9.34,1.93,;-8,2.69,;-6.67,1.93,;-6.67,.38,;-8,4.23,;-9.34,5,;-6.67,5,;-6.67,6.54,;,-1.93,;-1.33,-2.69,;-1.33,-4.23,;,-5,;,-6.54,;1.33,-4.23,;1.33,-2.69,)|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCCC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCOCC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N(CC)C(=O)C1CCN(CC1)C(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N(CC)C(=O)C1CCNCC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)NC1CCNCC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N(C1CCNCC1)C(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N(C)C1CCNCC1)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N(C)[C@@H]1CC[C@@H](CC1)N(C)C)c1ccc(Cl)cc1 |r,wD:31.37,28.30,2.2,(9.34,1.15,;8,.38,;6.67,1.15,;6.67,2.69,;5.33,.38,;4,1.15,;2.67,.38,;1.33,1.15,;,.38,;-1.33,1.15,;-1.33,2.69,;-2.67,3.47,;,3.47,;1.33,2.69,;2.67,3.47,;4,2.69,;5.33,3.47,;5.33,5,;-2.67,.38,;-2.67,-1.15,;-4,-1.93,;-5.33,-1.15,;-5.33,.38,;-4,1.15,;-6.67,-1.93,;-6.67,-3.47,;-8,-1.15,;-9.34,-1.93,;-8,.38,;-9.34,1.15,;-9.34,2.69,;-8,3.47,;-6.67,2.69,;-6.67,1.15,;-8,5,;-9.34,5.78,;-6.67,5.78,;,-1.15,;-1.33,-1.93,;-1.33,-3.47,;,-4.23,;,-5.78,;1.33,-3.47,;1.33,-1.93,)|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N([C@@H]1CC[C@@H](CC1)N(C)C)C(C)=O)c1ccc(Cl)cc1 |r,wD:30.36,27.29,2.2,(10,1.15,;8.67,.38,;7.34,1.15,;7.34,2.69,;6,.38,;4.67,1.15,;3.33,.38,;2,1.15,;.67,.38,;-.67,1.15,;-.67,2.69,;-2,3.47,;.67,3.47,;2,2.69,;3.33,3.47,;4.67,2.69,;6,3.47,;6,5,;-2,.38,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.15,;-6,-1.93,;-6,-3.47,;-7.34,-1.15,;-7.34,.38,;-8.67,1.15,;-8.67,2.69,;-7.34,3.47,;-6,2.69,;-6,1.15,;-7.34,5,;-8.67,5.78,;-6,5.78,;-8.67,-1.93,;-10,-1.15,;-8.67,-3.46,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;2,-1.93,)|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N[C@H]1CC[C@H](N)CC1)c1ccc(Cl)cc1 |r,wU:27.29,wD:30.33,2.2,(9.34,1.54,;8,.77,;6.67,1.54,;6.67,3.08,;5.33,.77,;4,1.54,;2.67,.77,;1.33,1.54,;,.77,;-1.33,1.54,;-1.33,3.08,;-2.67,3.85,;,3.85,;1.33,3.08,;2.67,3.85,;4,3.08,;5.33,3.85,;5.33,5.39,;-2.67,.77,;-2.67,-.77,;-4,-1.54,;-5.33,-.77,;-5.33,.77,;-4,1.54,;-6.67,-1.54,;-6.67,-3.08,;-8,-.77,;-8,.77,;-9.34,1.54,;-9.34,3.08,;-8,3.85,;-8,5.39,;-6.67,3.08,;-6.67,1.54,;,-.77,;-1.33,-1.54,;-1.33,-3.08,;,-3.85,;,-5.39,;1.33,-3.08,;1.33,-1.54,)|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCC(CC1)N(C)C)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCC(CC1)N(C)C(C)C)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCC(CC1)NC(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCN(CC1)C(C)=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2C(N(C(=O)Cc2cc1OC)c1ccc(cc1)C(C)N1CCOCC1=O)c1ccc(Cl)cc1 |r|
CC[C@@H](C)Oc1cc2[C@@H](N(C(=O)Cc2cc1OC)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N(C)C)c1ccc(Cl)cc1 |r,wU:30.36,wD:8.39,2.2,27.29,(9.34,7.63,;8,6.86,;6.67,7.63,;6.67,9.17,;5.33,6.86,;4,7.63,;2.67,6.86,;1.33,7.63,;,6.86,;-1.33,7.63,;-1.33,9.17,;-2.67,9.94,;,9.94,;1.33,9.17,;2.67,9.94,;4,9.17,;5.33,9.94,;5.33,11.48,;-2.67,6.86,;-2.67,5.32,;-4,4.55,;-5.33,5.32,;-5.33,6.86,;-4,7.63,;-6.67,4.55,;-6.67,3.01,;-8,5.32,;-8,6.86,;-6.67,7.63,;-6.67,9.17,;-8,9.94,;-9.34,9.17,;-9.34,7.63,;-8,11.48,;-9.34,12.25,;-6.67,12.25,;,5.32,;-1.33,4.55,;-1.33,3.01,;,2.24,;,.7,;1.33,3.01,;1.33,4.55,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N(C)C |r,wU:36.43,wD:9.9,33.36,(6,5,;6,3.46,;4.67,2.69,;3.33,3.46,;2,2.69,;.67,3.46,;-.67,2.69,;-2,3.46,;-.67,1.15,;.67,.38,;.67,-1.16,;-.67,-1.93,;-.67,-3.47,;.67,-4.24,;.67,-5.77,;2,-3.47,;2,-1.93,;2,1.15,;3.33,.38,;4.67,1.15,;6,.38,;7.34,1.15,;8.67,.38,;7.34,2.69,;-2,.38,;-2,-1.16,;-3.33,-1.93,;-4.67,-1.16,;-4.67,.38,;-3.33,1.15,;-6,-1.93,;-6,-3.47,;-7.34,-1.16,;-7.34,.38,;-6,1.15,;-6,2.69,;-7.34,3.46,;-8.67,2.69,;-8.67,1.15,;-7.34,5,;-8.67,5.77,;-6,5.77,)|
CCN(C[C@H]1CC[C@@H](CC1)N(C)C)c1ccc(cc1)N1[C@@H](c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O |r,wU:7.10,wD:20.22,4.3,(-7.34,-4.24,;-6,-3.47,;-6,-1.93,;-7.34,-1.16,;-7.34,.38,;-6,1.15,;-6,2.69,;-7.34,3.46,;-8.67,2.69,;-8.67,1.15,;-7.34,5,;-8.67,5.77,;-6,5.77,;-4.67,-1.16,;-3.33,-1.93,;-2,-1.16,;-2,.38,;-3.33,1.15,;-4.67,.38,;-.67,1.15,;.67,.38,;.67,-1.16,;-.67,-1.93,;-.67,-3.47,;.67,-4.24,;.67,-5.77,;2,-3.47,;2,-1.93,;2,1.15,;3.33,.38,;4.67,1.15,;6,.38,;7.34,1.15,;8.67,.38,;7.34,2.69,;4.67,2.69,;6,3.46,;6,5,;3.33,3.46,;2,2.69,;.67,3.46,;-.67,2.69,;-2,3.46,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)NS(C)(=O)=O |r,wU:36.43,wD:9.9,33.36,(6.67,4.34,;6.67,2.8,;5.33,2.03,;4,2.8,;2.67,2.03,;1.33,2.8,;,2.03,;-1.33,2.8,;,.49,;1.33,-.28,;1.33,-1.82,;,-2.59,;,-4.13,;1.33,-4.9,;1.33,-6.44,;2.67,-4.13,;2.67,-2.59,;2.67,.49,;4,-.28,;5.33,.49,;6.67,-.28,;8,.49,;9.34,-.28,;8,2.03,;-1.33,-.28,;-1.33,-1.82,;-2.67,-2.59,;-4,-1.82,;-4,-.28,;-2.67,.49,;-5.33,-2.59,;-5.33,-4.13,;-6.67,-1.82,;-6.67,-.28,;-5.33,.49,;-5.33,2.03,;-6.67,2.8,;-8,2.03,;-8,.49,;-6.67,4.34,;-8,5.11,;-9.34,4.34,;-8.77,6.44,;-7.23,6.44,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)NC(=O)c1cocn1 |r,wU:36.43,wD:9.9,33.36,(7.84,4.23,;7.84,2.69,;6.51,1.92,;5.18,2.69,;3.84,1.92,;2.51,2.69,;1.18,1.92,;-.16,2.69,;1.18,.38,;2.51,-.38,;2.51,-1.92,;1.18,-2.69,;1.18,-4.23,;2.51,-5.01,;2.51,-6.54,;3.84,-4.23,;3.84,-2.69,;3.84,.38,;5.18,-.38,;6.51,.38,;7.84,-.38,;9.18,.38,;10.51,-.38,;9.18,1.92,;-.16,-.38,;-1.49,.38,;-2.82,-.38,;-2.82,-1.92,;-1.49,-2.69,;-.16,-1.92,;-4.16,-2.69,;-4.16,-4.23,;-5.49,-1.92,;-5.49,-.38,;-4.16,.38,;-4.16,1.92,;-5.49,2.69,;-6.83,1.92,;-6.83,.38,;-5.49,4.23,;-6.81,5.01,;-6.8,6.54,;-8.14,4.23,;-8.14,2.69,;-9.61,2.22,;-10.51,3.47,;-9.61,4.71,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CCNC(=O)C1 |r,wU:36.43,wD:9.9,33.36,(6,3.85,;6,2.31,;4.67,1.54,;3.33,2.31,;2,1.54,;.67,2.31,;-.67,1.54,;-2,2.31,;-.67,,;.67,-.77,;.67,-2.31,;-.67,-3.08,;-.67,-4.62,;.67,-5.39,;.67,-6.93,;2,-4.62,;2,-3.08,;2,,;3.33,-.77,;4.67,,;6,-.77,;7.34,,;8.67,-.77,;7.34,1.54,;-2,-.77,;-3.33,,;-4.67,-.77,;-4.67,-2.31,;-3.33,-3.08,;-2,-2.31,;-6,-3.08,;-6,-4.62,;-7.34,-2.31,;-7.34,-.77,;-6,,;-6,1.54,;-7.34,2.31,;-8.67,1.54,;-8.67,,;-7.34,3.85,;-8.67,4.62,;-8.67,6.16,;-7.34,6.93,;-6,6.16,;-4.67,6.93,;-6,4.62,)|
COC(=O)CN(C)[C@H]1CC[C@H](CN(C)c2ccc(cc2)N2[C@@H](c3ccc(Cl)cc3)c3cc(OC(C)C)c(OC)cc3CC2=O)CC1 |r,wU:7.6,wD:21.22,10.10,(-3.33,6.16,;-4.67,6.93,;-6,6.16,;-7.34,6.93,;-6,4.62,;-7.34,3.85,;-8.65,4.62,;-7.34,2.31,;-6,1.54,;-6,,;-7.34,-.77,;-7.34,-2.31,;-6,-3.08,;-6,-4.62,;-4.67,-2.31,;-4.67,-.77,;-3.33,,;-2,-.77,;-2,-2.31,;-3.33,-3.08,;-.67,,;.67,-.77,;.67,-2.31,;-.67,-3.08,;-.67,-4.62,;.67,-5.39,;.67,-6.93,;2,-4.62,;2,-3.08,;2,,;3.33,-.77,;4.67,,;6,-.77,;7.34,,;8.67,-.77,;7.34,1.54,;4.67,1.54,;6,2.31,;6,3.85,;3.33,2.31,;2,1.54,;.67,2.31,;-.67,1.54,;-2,2.31,;-8.67,,;-8.67,1.54,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CCOCC1 |r,wU:36.43,wD:9.9,33.36,(6,3.85,;6,2.31,;4.67,1.54,;3.33,2.31,;2,1.54,;.67,2.31,;-.67,1.54,;-2,2.31,;-.67,,;.67,-.77,;.67,-2.31,;-.67,-3.08,;-.67,-4.62,;.67,-5.39,;.67,-6.93,;2,-4.62,;2,-3.08,;2,,;3.33,-.77,;4.67,,;6,-.77,;7.34,,;8.67,-.77,;7.34,1.54,;-2,-.77,;-3.33,,;-4.67,-.77,;-4.67,-2.31,;-3.33,-3.08,;-2,-2.31,;-6,-3.08,;-6,-4.62,;-7.34,-2.31,;-7.34,-.77,;-6,,;-6,1.54,;-7.34,2.31,;-8.67,1.54,;-8.67,,;-7.34,3.85,;-6,4.62,;-6,6.16,;-7.34,6.93,;-8.67,6.16,;-8.65,4.62,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CC(=O)NCC1=O |r,wU:36.43,wD:9.9,33.36,(6.67,3.85,;6.67,2.31,;5.34,1.54,;4,2.31,;2.67,1.54,;1.34,2.31,;0,1.54,;-1.33,2.31,;0,,;1.34,-.77,;1.34,-2.31,;0,-3.08,;0,-4.62,;1.34,-5.39,;1.34,-6.93,;2.67,-4.62,;2.67,-3.08,;2.67,,;4,-.77,;5.34,,;6.67,-.77,;8,,;9.34,-.77,;8,1.54,;-1.33,-.77,;-2.67,,;-4,-.77,;-4,-2.31,;-2.67,-3.08,;-1.33,-2.31,;-5.33,-3.08,;-5.33,-4.62,;-6.67,-2.31,;-6.67,-.77,;-5.33,,;-5.33,1.54,;-6.67,2.31,;-8,1.54,;-8,,;-6.67,3.85,;-7.98,4.62,;-8,6.16,;-9.34,6.92,;-6.67,6.93,;-5.33,6.16,;-5.33,4.62,;-4,3.85,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N(CC(N)=O)CC(N)=O |r,wU:36.43,wD:9.9,33.36,(7.33,3.85,;7.33,2.31,;5.99,1.54,;4.66,2.31,;3.33,1.54,;1.99,2.31,;.66,1.54,;-.68,2.31,;.66,,;1.99,-.77,;1.99,-2.31,;.66,-3.08,;.66,-4.62,;1.99,-5.39,;1.99,-6.93,;3.33,-4.62,;3.33,-3.08,;3.33,,;4.66,-.77,;5.99,,;7.33,-.77,;8.66,,;9.99,-.77,;8.66,1.54,;-.68,-.77,;-2.01,,;-3.34,-.77,;-3.34,-2.31,;-2.01,-3.08,;-.68,-2.31,;-4.68,-3.08,;-4.68,-4.62,;-6.01,-2.31,;-6.01,-.77,;-4.68,,;-4.68,1.54,;-6.01,2.31,;-7.34,1.54,;-7.34,,;-6.01,3.85,;-4.68,4.62,;-4.68,6.16,;-3.34,6.93,;-6.01,6.93,;-7.33,4.62,;-8.66,3.85,;-9.99,4.62,;-8.66,2.31,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CCCNC(=O)C1 |r,wU:36.43,wD:9.9,33.36,(6.94,3.45,;6.94,1.91,;5.61,1.14,;4.28,1.91,;2.94,1.14,;1.61,1.91,;.28,1.14,;-1.06,1.91,;.28,-.4,;1.61,-1.17,;1.61,-2.71,;.28,-3.48,;.28,-5.02,;1.61,-5.79,;1.61,-7.33,;2.94,-5.02,;2.94,-3.48,;2.94,-.4,;4.28,-1.17,;5.61,-.4,;6.94,-1.17,;8.28,-.4,;9.61,-1.17,;8.28,1.14,;-1.06,-1.17,;-2.39,-.4,;-3.73,-1.17,;-3.73,-2.71,;-2.39,-3.48,;-1.06,-2.71,;-5.06,-3.48,;-5.06,-5.02,;-6.39,-2.71,;-6.39,-1.17,;-5.06,-.4,;-5.06,1.14,;-6.39,1.91,;-7.73,1.14,;-7.73,-.4,;-6.39,3.45,;-5.01,4.12,;-4.66,5.62,;-5.62,6.82,;-7.18,7.33,;-8.12,5.62,;-9.61,6.02,;-7.78,4.12,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)[C@H](C)N1CCS(=O)(=O)CC1 |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)[C@H](C)N1CCN(CC1)C(C)=O |r|
CNC(=O)[C@H]1CCCN1[C@@H](C)c1ccc(cc1)N1[C@@H](c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O |r|
COC(=O)[C@@H]1CCCN1[C@@H](C)c1ccc(cc1)N1[C@@H](c2ccc(Cl)cc2)c2cc(OC(C)C)c(OC)cc2CC1=O |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C(=O)[C@H]1CC[C@@H](CC1)N(C)C |r,wU:37.44,wD:9.9,34.37,(6,5,;6,3.47,;4.67,2.69,;3.33,3.47,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-.67,1.15,;.67,.38,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;2,-1.93,;2,1.15,;3.33,.38,;4.67,1.15,;6,.38,;7.34,1.15,;8.67,.38,;7.34,2.69,;-2,.38,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-3.33,1.16,;-6,-1.93,;-6,-3.47,;-7.34,-1.15,;-8.67,-1.92,;-7.34,.38,;-6,1.16,;-6,2.7,;-7.34,3.47,;-8.67,2.7,;-8.67,1.16,;-7.34,5,;-6,5.78,;-8.67,5.78,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)C(C)CN1CCC(CC1)N(C)C |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)C(C)C(=O)N1CCC(CC1)N(C)C |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(Cn2ccnc2)cc1 |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1OC)N(C)C[C@H]1CC[C@@H](CC1)N1CCNC(=O)C1 |r,wU:35.38,wD:9.9,38.45,(8.67,1.54,;7.34,2.31,;6,1.54,;4.67,2.31,;3.33,1.54,;2,2.31,;.67,1.54,;-.67,2.31,;.67,,;2,-.77,;2,-2.31,;.67,-3.08,;.67,-4.62,;2,-5.39,;2,-6.93,;3.33,-4.62,;3.33,-3.08,;3.33,,;4.67,-.77,;6,,;7.34,-.77,;7.34,-2.31,;8.67,-3.08,;6,-3.08,;-.67,-.77,;-.67,-2.31,;-2,-3.08,;-3.33,-2.31,;-3.33,-.77,;-2,,;-2,1.54,;-3.33,2.31,;-4.67,-3.08,;-4.67,-4.62,;-6,-2.31,;-6,-.77,;-7.34,,;-7.34,1.54,;-6,2.31,;-4.67,1.54,;-4.67,,;-6,3.85,;-4.67,4.62,;-4.67,6.16,;-6,6.93,;-7.34,6.16,;-8.67,6.93,;-7.34,4.62,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)C1 |r,wU:33.36,wD:9.9,36.43,(8.11,1.23,;6.77,2,;5.44,1.23,;4.1,2,;2.77,1.23,;1.44,2,;.1,1.23,;-1.23,2,;.1,-.31,;1.44,-1.08,;1.44,-2.62,;.1,-3.39,;.1,-4.93,;1.44,-5.7,;1.44,-7.24,;2.77,-4.93,;2.77,-3.39,;2.77,-.31,;4.1,-1.08,;5.44,-.31,;6.77,-1.08,;6.77,-2.62,;8.11,-3.39,;5.44,-3.39,;-1.23,-1.08,;-2.56,-.31,;-3.9,-1.08,;-3.9,-2.62,;-2.56,-3.39,;-1.23,-2.62,;-5.23,-3.39,;-5.23,-4.93,;-6.57,-2.62,;-6.57,-1.08,;-7.9,-.31,;-7.9,1.23,;-6.57,2,;-5.23,1.23,;-5.23,-.31,;-6.57,3.54,;-5.32,4.44,;-5.8,5.91,;-5.03,7.24,;-7.34,5.91,;-8.11,7.24,;-7.81,4.44,)|
CC(C)Oc1cc2c(cc1OC)CC(=O)N([C@H]2c3ccc(cc3)Cl)c4ccc(cc4)N(C)CC5CCC(CC5)N6CCN(C(=O)C6)C
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CCN(CC1)C(C)=O |r,wU:33.36,wD:9.9,36.43,(8,.38,;6.67,1.15,;5.33,.38,;4,1.15,;2.67,.38,;1.33,1.15,;,.38,;-1.33,1.15,;,-1.15,;1.33,-1.93,;1.33,-3.47,;,-4.23,;,-5.78,;1.33,-6.54,;1.33,-8.08,;2.67,-5.78,;2.67,-4.23,;2.67,-1.15,;4,-1.93,;5.33,-1.15,;6.67,-1.93,;6.67,-3.47,;8,-4.23,;5.33,-4.23,;-1.33,-1.93,;-2.67,-1.15,;-4,-1.93,;-4,-3.47,;-2.67,-4.23,;-1.33,-3.47,;-5.33,-4.23,;-5.33,-5.78,;-6.67,-3.47,;-6.67,-1.93,;-8,-1.15,;-8,.38,;-6.67,1.15,;-5.33,.38,;-5.33,-1.15,;-6.67,2.69,;-5.33,3.47,;-5.33,5,;-6.67,5.78,;-8,5,;-8,3.47,;-6.67,7.31,;-8,8.08,;-5.33,8.08,)|
CNC(=O)CN[C@H]1CC[C@H](CN(C)c2ccc(nc2)N2[C@@H](c3ccc(Cl)cc3)c3cc(OC(C)C)c(OC)cc3CC2=O)CC1 |r,wU:6.5,wD:20.21,9.9,(-3.33,2.69,;-4.67,3.47,;-4.67,5,;-3.33,5.78,;-6,5.78,;-7.34,5,;-7.34,3.47,;-6,2.69,;-6,1.15,;-7.34,.38,;-7.34,-1.15,;-6,-1.93,;-6,-3.47,;-4.67,-1.15,;-3.33,-1.93,;-2,-1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-.67,1.15,;.67,.38,;.67,-1.15,;-.67,-1.93,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;2,-1.93,;2,1.15,;3.33,.38,;4.67,1.15,;6,.38,;7.34,1.15,;8.67,.38,;7.34,2.69,;4.67,2.69,;6,3.47,;6,5,;3.33,3.47,;2,2.69,;.67,3.47,;-.67,2.69,;-2,3.47,;-8.67,1.15,;-8.67,2.69,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cn1)N(C)CC1CC[C@@H](CC1)N1CCNC(=O)C1 |r,wU:36.43,wD:9.9,(6,3.85,;6,2.31,;4.67,1.54,;3.33,2.31,;2,1.54,;.67,2.31,;-.67,1.54,;-2,2.31,;-.67,,;.67,-.77,;.67,-2.31,;-.67,-3.08,;-.67,-4.62,;.67,-5.39,;.67,-6.93,;2,-4.62,;2,-3.08,;2,,;3.33,-.77,;4.67,,;6,-.77,;7.34,,;8.67,-.77,;7.34,1.54,;-2,-.77,;-2,-2.31,;-3.33,-3.08,;-4.67,-2.31,;-4.67,-.77,;-3.33,,;-6,-3.08,;-6,-4.62,;-7.34,-2.31,;-7.34,-.77,;-6,,;-6,1.54,;-7.34,2.31,;-8.67,1.54,;-8.67,,;-7.34,3.85,;-8.67,4.62,;-8.67,6.16,;-7.34,6.93,;-6,6.16,;-4.67,6.93,;-6,4.62,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cn1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(6.1,3.54,;6.1,2,;4.77,1.23,;3.44,2,;2.1,1.23,;.77,2,;-.56,1.23,;-1.9,2,;-.56,-.31,;.77,-1.08,;.77,-2.62,;-.56,-3.39,;-.56,-4.93,;.77,-5.7,;.77,-7.24,;2.1,-4.93,;2.1,-3.39,;2.1,-.31,;3.44,-1.08,;4.77,-.31,;6.1,-1.08,;7.44,-.31,;8.77,-1.08,;7.44,1.23,;-1.9,-1.08,;-1.9,-2.62,;-3.23,-3.39,;-4.56,-2.62,;-4.56,-1.08,;-3.23,-.31,;-5.9,-3.39,;-5.9,-4.93,;-7.23,-2.62,;-7.23,-1.08,;-5.9,-.31,;-5.9,1.23,;-7.23,2,;-8.57,1.23,;-8.57,-.31,;-7.23,3.54,;-8.48,4.44,;-8,5.91,;-8.77,7.24,;-6.46,5.91,;-5.69,7.24,;-5.99,4.44,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cn1)N(C)C[C@H]1CC[C@@H](CC1)N1CCN(C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(6,3.08,;6,1.54,;4.67,.77,;3.33,1.54,;2,.77,;.67,1.54,;-.67,.77,;-2,1.54,;-.67,-.77,;.67,-1.54,;.67,-3.08,;-.67,-3.85,;-.67,-5.39,;.67,-6.16,;.67,-7.7,;2,-5.39,;2,-3.85,;2,-.77,;3.33,-1.54,;4.67,-.77,;6,-1.54,;7.34,-.77,;8.67,-1.54,;7.34,.77,;-2,-1.54,;-2,-3.08,;-3.33,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-3.33,-.77,;-6,-3.85,;-6,-5.39,;-7.34,-3.08,;-7.34,-1.54,;-6,-.77,;-6,.77,;-7.34,1.54,;-8.67,.77,;-8.67,-.77,;-7.34,3.08,;-8.67,3.85,;-8.67,5.39,;-7.34,6.16,;-7.34,7.7,;-6,5.39,;-4.67,6.16,;-6,3.85,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(nc1)N(C)C[C@H]1CC[C@@H](CC1)N1CCN(C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(12,5,;10.67,5.78,;9.34,5,;8,5.78,;6.67,5,;5.33,5.78,;4,5,;2.67,5.78,;4,3.47,;5.33,2.69,;5.33,1.15,;4,.38,;4,-1.15,;5.33,-1.93,;5.33,-3.47,;6.67,-1.15,;6.67,.38,;6.67,3.47,;8,2.69,;9.34,3.47,;10.67,2.69,;10.67,1.15,;12,.38,;9.34,.38,;2.67,2.69,;2.67,1.15,;1.33,.38,;,1.15,;,2.69,;1.33,3.47,;-1.33,.38,;-1.33,-1.15,;-2.67,1.15,;-4,.38,;-5.33,1.15,;-6.67,.38,;-6.67,-1.15,;-5.33,-1.93,;-4,-1.15,;-8,-1.93,;-9.34,-1.15,;-10.67,-1.93,;-10.67,-3.47,;-12,-4.23,;-9.34,-4.23,;-9.34,-5.78,;-8,-3.47,)|
CCN1CN(CC1=O)[C@H]1CC[C@H](CN(C)c2ccc(cn2)N2[C@@H](c3ccc(Cl)cc3)c3cc(OC(C)C)c(OC)cc3CC2=O)CC1 |r,wU:8.8,wD:22.24,11.12,(-9.51,-6.19,;-10.28,-4.86,;-9.51,-3.52,;-8.05,-3.05,;-8.05,-1.51,;-9.51,-1.03,;-10.42,-2.28,;-11.96,-2.28,;-6.71,-.74,;-6.71,.8,;-5.38,1.57,;-4.05,.8,;-2.71,1.57,;-1.38,.8,;-1.38,-.74,;-.05,1.57,;1.29,.8,;2.62,1.57,;2.62,3.11,;1.29,3.88,;-.05,3.11,;3.96,3.88,;5.29,3.11,;5.29,1.57,;3.96,.8,;3.96,-.74,;5.29,-1.51,;5.29,-3.05,;6.62,-.74,;6.62,.8,;6.62,3.88,;7.96,3.11,;9.29,3.88,;10.62,3.11,;10.62,1.57,;11.96,.8,;9.29,.8,;9.29,5.42,;10.62,6.19,;11.96,5.42,;7.96,6.19,;6.62,5.42,;5.29,6.19,;3.96,5.42,;2.62,6.19,;-4.05,-.74,;-5.38,-1.51,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1cnc(cn1)N(C)C[C@H]1CC[C@@H](CC1)N1CCN(C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(12,4.23,;10.67,5,;9.34,4.23,;8,5,;6.67,4.23,;5.33,5,;4,4.23,;2.67,5,;4,2.69,;5.33,1.93,;5.33,.38,;4,-.38,;4,-1.93,;5.33,-2.69,;5.33,-4.23,;6.67,-1.93,;6.67,-.38,;6.67,2.69,;8,1.93,;9.34,2.69,;10.67,1.93,;10.67,.38,;12,-.38,;9.34,-.38,;2.67,1.93,;2.67,.38,;1.33,-.38,;,.38,;,1.93,;1.33,2.69,;-1.33,-.38,;-1.33,-1.93,;-2.67,.38,;-4,-.38,;-5.33,.38,;-6.67,-.38,;-6.67,-1.93,;-5.33,-2.69,;-4,-1.93,;-8,-2.69,;-8,-4.23,;-9.34,-5,;-10.67,-4.23,;-12,-5,;-10.67,-2.69,;-12,-1.93,;-9.34,-1.93,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cn1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C(C)C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(6.87,2.87,;6.87,1.33,;5.54,.56,;4.21,1.33,;2.87,.56,;1.54,1.33,;.21,.56,;-1.13,1.33,;.21,-.98,;1.54,-1.75,;1.54,-3.29,;.21,-4.06,;.21,-5.6,;1.54,-6.37,;1.54,-7.91,;2.87,-5.6,;2.87,-4.06,;2.87,-.98,;4.21,-1.75,;5.54,-.98,;6.87,-1.75,;8.21,-.98,;9.54,-1.75,;8.21,.56,;-1.13,-1.75,;-1.13,-3.29,;-2.46,-4.06,;-3.79,-3.29,;-3.79,-1.75,;-2.46,-.98,;-5.13,-4.06,;-5.13,-5.6,;-6.46,-3.29,;-6.46,-1.75,;-5.13,-.98,;-5.13,.56,;-6.46,1.33,;-7.8,.56,;-7.8,-.98,;-6.46,2.87,;-7.71,3.78,;-7.23,5.24,;-8,6.57,;-7.23,7.91,;-9.54,6.57,;-5.69,5.24,;-4.92,6.57,;-5.22,3.78,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1cnc(cn1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)C1 |r,wU:36.43,wD:9.9,33.36,(11.96,4.75,;10.62,5.52,;9.29,4.75,;7.96,5.52,;6.62,4.75,;5.29,5.52,;3.96,4.75,;2.62,5.52,;3.96,3.21,;5.29,2.44,;5.29,.9,;3.96,.13,;3.96,-1.41,;5.29,-2.18,;5.29,-3.72,;6.62,-1.41,;6.62,.13,;6.62,3.21,;7.96,2.44,;9.29,3.21,;10.62,2.44,;10.62,.9,;11.96,.13,;9.29,.13,;2.62,2.44,;2.62,.9,;1.29,.13,;-.05,.9,;-.05,2.44,;1.29,3.21,;-1.38,.13,;-1.38,-1.41,;-2.71,.9,;-4.05,.13,;-5.38,.9,;-6.71,.13,;-6.71,-1.41,;-5.38,-2.18,;-4.05,-1.41,;-8.05,-2.18,;-8.05,-3.72,;-9.51,-4.19,;-10.28,-5.52,;-10.42,-2.95,;-11.96,-2.95,;-9.51,-1.7,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)[C@H](C)N1CCNCC1=O |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)[C@H](C)NC(C)=O |r|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC1CCC1)c1ccc(nc1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)C1 |r,wU:37.45,wD:9.9,34.38,(11.96,4.75,;10.62,5.52,;9.29,4.75,;7.96,5.52,;6.62,4.75,;5.29,5.52,;3.96,4.75,;2.62,5.52,;3.96,3.21,;5.29,2.44,;5.29,.9,;3.96,.13,;3.96,-1.41,;5.29,-2.18,;5.29,-3.72,;6.62,-1.41,;6.62,.13,;6.62,3.21,;7.96,2.44,;9.29,3.21,;10.62,2.44,;10.62,.9,;9.53,-.18,;10.62,-1.27,;11.71,-.18,;2.62,2.44,;1.29,3.21,;-.05,2.44,;-.05,.9,;1.29,.13,;2.62,.9,;-1.38,.13,;-1.38,-1.41,;-2.71,.9,;-4.05,.13,;-5.38,.9,;-6.71,.13,;-6.71,-1.41,;-5.38,-2.18,;-4.05,-1.41,;-8.05,-2.18,;-8.05,-3.72,;-9.51,-4.19,;-10.28,-5.52,;-10.42,-2.95,;-11.96,-2.95,;-9.51,-1.7,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OCC1CCCO1)c1ccc(nc1)N(C)C[C@H]1CC[C@@H](CC1)N1CN(C)C(=O)C1 |r,wU:39.47,wD:9.9,36.40,(10.77,4.75,;9.44,5.52,;8.11,4.75,;6.77,5.52,;5.44,4.75,;4.1,5.52,;2.77,4.75,;1.44,5.52,;2.77,3.21,;4.1,2.44,;4.1,.9,;2.77,.13,;2.77,-1.41,;4.1,-2.18,;4.1,-3.72,;5.44,-1.41,;5.44,.13,;5.44,3.21,;6.77,2.44,;8.11,3.21,;9.44,2.44,;9.44,.9,;10.77,.13,;12.24,.61,;13.14,-.64,;12.24,-1.88,;10.77,-1.41,;1.44,2.44,;.1,3.21,;-1.23,2.44,;-1.23,.9,;.1,.13,;1.44,.9,;-2.56,.13,;-2.56,-1.41,;-3.9,.9,;-5.23,.13,;-6.57,.9,;-7.9,.13,;-7.9,-1.41,;-6.57,-2.18,;-5.23,-1.41,;-9.23,-2.18,;-9.23,-3.72,;-10.7,-4.19,;-11.47,-5.52,;-11.6,-2.95,;-13.14,-2.95,;-10.7,-1.7,)|
COc1cc2CC(=O)N([C@@H](c3ccc(Cl)cc3)c2cc1OC(C)C)c1ccc(cc1)[C@H](C)N1CCN(CC1=O)C(C)=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)C=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCC(=O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CNC(C)(C)C |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)N[C@H]1CC[C@@H](O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CN1CCCC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CN1CC[C@@H](O)C1 |r|
CC(O)C(O)CCNC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCN1CC[C@H](O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC1CC(O)C(O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCCN1CCCC1 |r|
CNC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(N)=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCCN1CCCC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCCN1CCCCC1 |r|
CC(C)N1CCN(CCCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r|
CN1CCN(CCCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCCN1CCN(CC1)C1CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCN(CC1)S(C)(=O)=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(N)=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@@H](O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCN(CCF)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC(O)C1 |r,wU:8.8,31.34,wD:17.19,7.31,5.4,(4.23,.16,;3.83,-1.33,;4.92,-2.42,;5.32,-.93,;2.34,-1.73,;1.25,-.64,;1.25,.9,;-.21,1.38,;-1.12,.13,;-2.6,.53,;-3.69,-.56,;-5.18,-.16,;-5.58,1.33,;-4.49,2.41,;-4.89,3.9,;-3,2.02,;-3,3.56,;-.21,-1.12,;.69,-2.36,;2.03,-3.13,;-.21,-3.61,;-1.68,-3.13,;-3.01,-3.9,;-4.34,-3.13,;-5.68,-3.9,;-4.34,-1.59,;-3.01,-.82,;-1.68,-1.59,;-.21,2.92,;-1.54,3.69,;1.12,3.69,;2.46,2.92,;3.94,3.31,;4.34,1.83,;5.68,1.06,;2.86,1.43,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@H](C1)NS(C)(=O)=O |r,wU:8.8,31.34,wD:17.19,7.31,5.4,33.39,(3.46,.16,;3.06,-1.33,;4.15,-2.42,;4.55,-.93,;1.57,-1.73,;.48,-.64,;.48,.9,;-.98,1.38,;-1.89,.13,;-3.37,.53,;-4.46,-.56,;-5.95,-.16,;-6.35,1.33,;-5.26,2.41,;-5.66,3.9,;-3.77,2.02,;-3.77,3.56,;-.98,-1.12,;-.08,-2.36,;1.26,-3.13,;-.98,-3.61,;-2.45,-3.13,;-3.78,-3.9,;-5.11,-3.13,;-6.45,-3.9,;-5.11,-1.59,;-3.78,-.82,;-2.45,-1.59,;-.98,2.92,;-2.31,3.69,;.35,3.69,;1.69,2.92,;3.17,3.31,;3.59,1.82,;2.09,1.43,;4.93,1.05,;6.26,1.82,;7.59,2.59,;7.03,.48,;5.49,3.15,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC(C)(C)O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCN1CCNCC1 |r|
CN1CCN(CCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2)C(=O)Nc2cc(Cl)c(F)cc32)CC1 |r|
CN1CCN(CCCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2)C(=O)Nc2cc(Cl)c(F)cc32)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCC(C)(O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCCN1CCCC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@H](CC1)NS(C)(=O)=O |r,wU:8.8,34.41,wD:17.19,5.4,7.31,(3.59,-1.93,;2.26,-1.16,;2.26,.38,;3.59,-.39,;.92,-1.93,;-.41,-1.16,;-.41,.38,;-1.88,.86,;-2.78,-.39,;-4.27,.01,;-5.36,-1.08,;-6.84,-.68,;-7.24,.81,;-6.15,1.9,;-6.55,3.39,;-4.67,1.5,;-4.67,3.04,;-1.88,-1.63,;-.97,-2.88,;.57,-2.88,;-1.88,-4.12,;-3.34,-3.65,;-4.67,-4.42,;-6.01,-3.65,;-7.34,-4.42,;-6.01,-2.11,;-4.67,-1.34,;-3.34,-2.11,;-2.27,2.35,;-3.76,2.75,;-1.19,3.44,;.3,3.04,;.7,1.55,;2.19,1.15,;3.28,2.24,;2.88,3.73,;1.39,4.13,;4.76,1.84,;5.85,2.93,;7.34,2.53,;4.76,4.02,;6.25,4.42,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@H](CC1)NS(C)(=O)=O |r,wU:8.8,wD:17.19,5.4,7.31,34.41,(3.59,-1.93,;2.26,-1.16,;2.26,.38,;3.59,-.39,;.92,-1.93,;-.41,-1.16,;-.41,.38,;-1.88,.86,;-2.78,-.39,;-4.27,.01,;-5.36,-1.08,;-6.84,-.68,;-7.24,.81,;-6.15,1.9,;-6.55,3.39,;-4.67,1.5,;-4.67,3.04,;-1.88,-1.63,;-.97,-2.88,;.57,-2.88,;-1.88,-4.12,;-3.34,-3.65,;-4.67,-4.42,;-6.01,-3.65,;-7.34,-4.42,;-6.01,-2.11,;-4.67,-1.34,;-3.34,-2.11,;-2.27,2.35,;-3.76,2.75,;-1.19,3.44,;.3,3.04,;1.39,4.13,;2.88,3.73,;3.28,2.24,;2.19,1.15,;.7,1.55,;4.76,1.84,;5.85,2.93,;7.34,2.53,;4.76,4.02,;6.25,4.42,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCN(CC1)S(C)(=O)=O |r|
CCNC(=O)N1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)N1CCNCC1 |r|
CN1CCN(CC1)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC(=O)N1CCN(CC1)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN(C)CC(=O)N1CCN(CC1)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN(C)CCC(=O)N1CCN(CC1)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCN1CCC(O)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H]1CC[C@@H](C1)NS(C)(=O)=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H]1CC[C@H](N)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCCNS(C)(=O)=O |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCNS(C)(=O)=O |r|
C[C@H](N)C(=O)O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:24.26,1.1,wD:23.35,17.18,15.15,6.5,(7.2,1.04,;6.8,2.53,;7.89,3.62,;5.31,2.93,;4.91,4.42,;4.22,1.84,;2.73,2.24,;2.33,3.73,;.85,4.13,;-.24,3.04,;.16,1.55,;1.64,1.15,;-1.73,3.44,;-2.82,2.35,;-4.31,2.75,;-2.42,.86,;-.96,.38,;-.96,-1.16,;.38,-1.93,;1.47,-1.3,;2.8,-2.07,;1.47,.24,;2.8,-.53,;-2.42,-1.63,;-3.33,-.39,;-4.81,.01,;-5.9,-1.08,;-7.39,-.68,;-7.79,.81,;-6.7,1.9,;-7.1,3.39,;-5.21,1.5,;-5.21,3.04,;-1.51,-2.88,;.03,-2.88,;-2.42,-4.12,;-3.88,-3.65,;-5.22,-4.42,;-6.55,-3.65,;-7.89,-4.42,;-6.55,-2.11,;-5.22,-1.34,;-3.88,-2.11,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC1CC[C@H](N)CC1 |r,wU:8.8,34.38,wD:16.18,5.4,7.31,(4.63,-1.92,;3.3,-1.15,;3.3,.39,;4.63,-.38,;2.21,-1.78,;.88,-1.01,;.88,.53,;-.59,1.01,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-.59,-1.49,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-6.05,-1.19,;-3.39,-1.19,;-2.05,-1.96,;-.99,2.49,;-2.47,2.89,;.1,3.58,;1.59,3.18,;1.99,1.7,;3.48,1.3,;4.57,2.39,;6.05,1.99,;4.17,3.87,;2.68,4.27,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCNCC1 |r|
CC(=O)N1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCN(CCO)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCN(CC(C)(C)O)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC1CC[C@@H](CC1)NS(=O)(=O)C(F)(F)F |r,wU:8.8,34.41,wD:16.18,5.4,7.31,(3.49,-1.92,;2.16,-1.15,;2.16,.39,;3.49,-.38,;1.07,-1.78,;-.27,-1.01,;-.27,.53,;-1.73,1.01,;-2.63,-.24,;-4.12,.16,;-5.21,-.93,;-6.7,-.53,;-7.1,.96,;-6.01,2.04,;-6.41,3.53,;-4.52,1.65,;-1.73,-1.49,;-.82,-2.73,;.72,-2.73,;-1.73,-3.98,;-3.19,-3.5,;-4.53,-4.27,;-5.86,-3.5,;-7.2,-4.27,;-5.86,-1.96,;-7.2,-1.19,;-4.53,-1.19,;-3.19,-1.96,;-2.13,2.49,;-3.62,2.89,;-1.04,3.58,;.45,3.18,;.85,1.7,;2.33,1.3,;3.52,2.32,;3.02,3.87,;1.54,4.27,;5,1.91,;6.1,2.98,;7.18,1.88,;5.03,4.08,;7.2,4.06,;8.31,5.13,;8.28,2.95,;6.13,5.16,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCN(CC1)S(=O)(=O)C(F)(F)F |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@](C)(O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@@](C)(O)CO |r|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC2CCCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.23,wD:19.32,10.10,1.0,12.13,(6.05,1.99,;4.57,2.39,;4.17,3.87,;2.68,4.27,;1.59,3.18,;1.99,1.7,;3.48,1.3,;.1,3.58,;-.99,2.49,;-2.47,2.89,;-.59,1.01,;.88,.53,;.88,-1.01,;2.21,-1.78,;3.54,-1.01,;4.02,.45,;5.56,.45,;6.04,-1.01,;4.79,-1.92,;-.59,-1.49,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,)|
O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](C=C2CCCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.23,wD:19.32,10.10,1.0,12.13,(6.05,1.99,;4.57,2.39,;4.17,3.87,;2.68,4.27,;1.59,3.18,;1.99,1.7,;3.48,1.3,;.1,3.58,;-.99,2.49,;-2.47,2.89,;-.59,1.01,;.88,.53,;.88,-1.01,;2.21,-1.78,;3.54,-1.01,;4.02,.45,;5.56,.45,;6.04,-1.01,;4.79,-1.92,;-.59,-1.49,;-1.49,-.24,;-2.98,.16,;-4.07,-.93,;-5.56,-.53,;-5.96,.96,;-4.87,2.04,;-5.26,3.53,;-3.38,1.65,;-3.78,3.13,;.32,-2.73,;1.86,-2.73,;-.59,-3.98,;-2.05,-3.5,;-3.39,-4.27,;-4.72,-3.5,;-6.05,-4.27,;-4.72,-1.96,;-3.39,-1.19,;-2.05,-1.96,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CN(CC(C)(C)O)C1 |r|
CC(C)NC(=O)N1CC(C1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CN(CCO)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CN(C1)C(=O)NC1CCCCC1 |r|
CC(=O)OC(C)(C)C(=O)N1CC(C1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CC(=O)N1CC(C1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CCCCNC(=O)N1CC(C1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CCN(CC)C(=O)N1CC(C1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@H](CC1)OC(=O)CN |r,wU:8.8,wD:17.19,7.31,5.4,34.41,(3.05,-1.93,;1.71,-1.16,;1.71,.38,;3.05,-.39,;.38,-1.93,;-.96,-1.16,;-.96,.38,;-2.42,.86,;-3.33,-.39,;-4.81,.01,;-5.9,-1.08,;-7.39,-.68,;-7.79,.81,;-6.7,1.9,;-7.1,3.39,;-5.21,1.5,;-5.61,2.99,;-2.42,-1.63,;-1.51,-2.88,;.03,-2.88,;-2.42,-4.12,;-3.88,-3.65,;-5.22,-4.42,;-6.55,-3.65,;-7.89,-4.42,;-6.55,-2.11,;-5.22,-1.34,;-3.88,-2.11,;-2.82,2.35,;-4.31,2.75,;-1.73,3.44,;-.24,3.04,;.85,4.13,;2.33,3.73,;2.73,2.24,;1.64,1.15,;.16,1.55,;4.22,1.84,;5.31,2.93,;4.91,4.42,;6.8,2.53,;7.89,3.62,)|
CC(C)[C@H](N)C(=O)O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:26.28,3.3,wD:25.37,17.17,19.20,8.7,(5.71,-.04,;6.8,1.04,;8.28,.65,;6.4,2.53,;7.49,3.62,;4.91,2.93,;4.51,4.42,;3.82,1.84,;2.33,2.24,;1.94,3.73,;.45,4.13,;-.64,3.04,;-.24,1.55,;1.25,1.15,;-2.13,3.44,;-3.22,2.35,;-4.7,2.75,;-2.82,.86,;-1.35,.38,;-1.35,-1.16,;-.02,-1.93,;1.31,-1.16,;2.65,-1.93,;1.31,.38,;2.65,-.39,;-2.82,-1.63,;-3.72,-.39,;-5.21,.01,;-6.3,-1.08,;-7.79,-.68,;-8.19,.81,;-7.1,1.9,;-7.5,3.39,;-5.61,1.5,;-6.01,2.99,;-1.91,-2.88,;-.37,-2.88,;-2.82,-4.12,;-4.28,-3.65,;-5.62,-4.42,;-6.95,-3.65,;-8.28,-4.42,;-6.95,-2.11,;-5.62,-1.34,;-4.28,-2.11,)|
CC(C)C[C@H](N)C(=O)O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:27.29,4.4,wD:26.38,18.18,20.21,9.8,(8.14,-.84,;7.74,.65,;8.83,1.73,;6.25,1.04,;5.85,2.53,;6.94,3.62,;4.37,2.93,;3.97,4.42,;3.28,1.84,;1.79,2.24,;1.39,3.73,;-.1,4.13,;-1.19,3.04,;-.79,1.55,;.7,1.15,;-2.67,3.44,;-3.76,2.35,;-5.25,2.75,;-3.36,.86,;-1.9,.38,;-1.9,-1.16,;-.56,-1.93,;.77,-1.16,;2.1,-1.93,;.77,.38,;2.1,-.39,;-3.36,-1.63,;-4.27,-.39,;-5.76,.01,;-6.84,-1.08,;-8.33,-.68,;-8.73,.81,;-7.64,1.9,;-8.04,3.39,;-6.15,1.5,;-6.55,2.99,;-2.46,-2.88,;-.92,-2.88,;-3.36,-4.12,;-4.83,-3.65,;-6.16,-4.42,;-7.5,-3.65,;-8.83,-4.42,;-7.5,-2.11,;-6.16,-1.34,;-4.83,-2.11,)|
CC[C@H](C)[C@H](N)C(=O)O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:27.29,4.4,wD:26.38,18.18,20.21,9.8,2.2,(8.48,-.84,;8.09,.65,;6.6,1.04,;5.51,-.04,;6.2,2.53,;7.29,3.62,;4.71,2.93,;4.31,4.42,;3.62,1.84,;2.13,2.24,;1.74,3.73,;.25,4.13,;-.84,3.04,;-.44,1.55,;1.05,1.15,;-2.33,3.44,;-3.42,2.35,;-4.9,2.75,;-3.02,.86,;-1.55,.38,;-1.55,-1.16,;-.22,-1.93,;1.11,-1.16,;2.45,-1.93,;1.11,.38,;2.45,-.39,;-3.02,-1.63,;-3.92,-.39,;-5.41,.01,;-6.5,-1.08,;-7.99,-.68,;-8.39,.81,;-7.3,1.9,;-7.7,3.39,;-5.81,1.5,;-6.21,2.99,;-2.11,-2.88,;-.57,-2.88,;-3.02,-4.12,;-4.48,-3.65,;-5.82,-4.42,;-7.15,-3.65,;-8.48,-4.42,;-7.15,-2.11,;-5.82,-1.34,;-4.48,-2.11,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@H](CC1)OC(=O)[C@@H](N)Cc1ccccc1 |r,wU:8.8,40.45,wD:17.19,7.31,5.4,34.41,(1.16,-1.93,;-.17,-1.16,;-.17,.38,;1.16,-.39,;-1.51,-1.93,;-2.84,-1.16,;-2.84,.38,;-4.31,.86,;-5.21,-.39,;-6.7,.01,;-7.79,-1.08,;-9.28,-.68,;-9.67,.81,;-8.58,1.9,;-8.98,3.39,;-7.1,1.5,;-7.5,2.99,;-4.31,-1.63,;-3.4,-2.88,;-1.86,-2.88,;-4.31,-4.12,;-5.77,-3.65,;-7.1,-4.42,;-8.44,-3.65,;-9.77,-4.42,;-8.44,-2.11,;-7.1,-1.34,;-5.77,-2.11,;-4.7,2.35,;-6.19,2.75,;-3.62,3.44,;-2.13,3.04,;-1.04,4.13,;.45,3.73,;.85,2.24,;-.24,1.15,;-1.73,1.55,;2.33,1.84,;3.42,2.93,;3.02,4.42,;4.91,2.53,;6,3.62,;5.31,1.04,;6.8,.65,;7.2,-.84,;8.68,-1.24,;9.77,-.15,;9.37,1.34,;7.89,1.73,)|
CC(C)[C@@H](N)C(=O)O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:26.28,wD:25.37,17.17,19.20,8.7,3.3,(8.28,.65,;6.8,1.04,;5.71,-.04,;6.4,2.53,;7.49,3.62,;4.91,2.93,;4.51,4.42,;3.82,1.84,;2.33,2.24,;1.94,3.73,;.45,4.13,;-.64,3.04,;-.24,1.55,;1.25,1.15,;-2.13,3.44,;-3.22,2.35,;-4.7,2.75,;-2.82,.86,;-1.35,.38,;-1.35,-1.16,;-.02,-1.93,;1.31,-1.16,;2.65,-1.93,;1.31,.38,;2.65,-.39,;-2.82,-1.63,;-3.72,-.39,;-5.21,.01,;-6.3,-1.08,;-7.79,-.68,;-8.19,.81,;-7.1,1.9,;-7.5,3.39,;-5.61,1.5,;-6.01,2.99,;-1.91,-2.88,;-.37,-2.88,;-2.82,-4.12,;-4.28,-3.65,;-5.62,-4.42,;-6.95,-3.65,;-8.28,-4.42,;-6.95,-2.11,;-5.62,-1.34,;-4.28,-2.11,)|
C[C@@H](N)C(=O)O[C@H]1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:24.26,wD:23.35,15.15,17.18,6.5,1.1,(7.2,1.04,;6.8,2.53,;7.89,3.62,;5.31,2.93,;4.91,4.42,;4.22,1.84,;2.73,2.24,;2.33,3.73,;.85,4.13,;-.24,3.04,;.16,1.55,;1.64,1.15,;-1.73,3.44,;-2.82,2.35,;-4.31,2.75,;-2.42,.86,;-.96,.38,;-.96,-1.16,;.38,-1.93,;1.71,-1.16,;3.05,-1.93,;1.71,.38,;3.05,-.39,;-2.42,-1.63,;-3.33,-.39,;-4.81,.01,;-5.9,-1.08,;-7.39,-.68,;-7.79,.81,;-6.7,1.9,;-7.1,3.39,;-5.21,1.5,;-5.61,2.99,;-1.51,-2.88,;.03,-2.88,;-2.42,-4.12,;-3.88,-3.65,;-5.22,-4.42,;-6.55,-3.65,;-7.89,-4.42,;-6.55,-2.11,;-5.22,-1.34,;-3.88,-2.11,)|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CC[C@@H](CC1)OC(=O)C(C)(C)N |r,wU:8.8,wD:17.19,7.31,5.4,34.41,(3.05,-1.93,;1.71,-1.16,;1.71,.38,;3.05,-.39,;.38,-1.93,;-.96,-1.16,;-.96,.38,;-2.42,.86,;-3.33,-.39,;-4.81,.01,;-5.9,-1.08,;-7.39,-.68,;-7.79,.81,;-6.7,1.9,;-7.1,3.39,;-5.21,1.5,;-5.61,2.99,;-2.42,-1.63,;-1.51,-2.88,;.03,-2.88,;-2.42,-4.12,;-3.88,-3.65,;-5.22,-4.42,;-6.55,-3.65,;-7.89,-4.42,;-6.55,-2.11,;-5.22,-1.34,;-3.88,-2.11,;-2.82,2.35,;-4.31,2.75,;-1.73,3.44,;-.24,3.04,;.85,4.13,;2.33,3.73,;2.73,2.24,;1.64,1.15,;.16,1.55,;4.22,1.84,;5.31,2.93,;4.91,4.42,;6.8,2.53,;6.4,1.04,;7.89,1.44,;7.89,3.62,)|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCc2ccccc2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CCC[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCc2cccs2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCCc2ccccc2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC(C)CC[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CC2CC2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCc2ccsc2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CCCc2ccccc2)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCCc2cccs2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CCCc2cccs2)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCC2CCCC2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CCC2CCCC2)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CCc2cccs2)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CCc2ccco2)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN1[C@H](CC(C)(C)C)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1F)C(=O)Nc1cc(F)c(F)cc21 |r|
CC(C)(C)C[C@@H]1[C@@]2([C@H]([C@H](C(=O)NCC[C@H](O)CO)[N+]1(C)C)c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CCC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCCN1CCOCC1 |r|
CCC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CCCCC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2c1cccc2Cl)C(=O)NCC[C@H](O)CO |r|
CCCCC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CCCC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCCN1CCOCC1 |r|
CC(C)CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N[C@H]([C@H](c2ccc(F)c(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)CC(C)(C)C[C@H]1N(C)[C@H]([C@H](c2ccc(F)c(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)N1CCN(CC1)C(=O)C1CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)N(C(=O)C2CC2)c2cc(Cl)c(F)cc12)C(=O)N1CCN(CC1)C(=O)C1CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@H]1CC[C@@H](O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCC1CCC(O)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](Cc2ccccc2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](Cc2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC[C@H](O)[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CN |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2ccc(F)c(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)COC(=O)CC(O)=O |r|
CCOP(=O)(OCC)OC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1ccc(F)c(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN(C)C[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1ccc(F)c(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CN(CC[C@H](O)CO)C(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CNC[C@@H](O)CCNC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1ccc(F)c(Cl)c1)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCN1CCN(CC1)C(=O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cncc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cc(Cl)ccn2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(CCO)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
OCCC1(C[C@H]2N[C@H]([C@H](c3cccc(Cl)c3)[C@@]22C(=O)Nc3cc(Cl)c(F)cc23)C(=O)NCC[C@H](O)CO)CCCC1 |r|
OC[C@@H](O)CCNC(=O)[C@H]1[C@H](c2cccc(Cl)c2)[C@]2([C@H]3CC4(CCCC4)CCN13)C(=O)Nc1cc(Cl)c(F)cc21 |r|
CC[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCN1CCOCC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2ccc(F)c(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(F)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2ccc(F)c(F)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2ccc(F)c(Cl)c2)[C@@]11C(=O)Nc2cc(F)ccc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(F)ccc12)C(=O)NCC[C@H](O)CO |r|
CN1[C@H](CC(C)(C)C)[C@@]2([C@H]([C@@H]1C(=O)NCC[C@H](O)CO)c1cccc(Cl)c1)C(=O)Nc1cc(F)ccc21 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCCCO |r|
CC(C)(C)C[C@H]1N[C@@H](CO)[C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12 |r|
CCCN1CCN(CCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2)C(=O)Nc2cc(Cl)c(F)cc32)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(F)c(F)cc12)C(=O)NCCC1CCC(O)C1 |r,w:32.36,36.40|
CN1CCC(CC1)NC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CN1CCC(CNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@@H](N)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCN(CCC(F)(F)F)CC1 |r|
CN1CC[C@@H](NC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)[C@@H](F)C1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@@H]1CCN(CCF)C[C@@H]1F |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CN(CC(F)F)C1 |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(CC(C)C)C(C)=O)C(=O)NCc1ccccc1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C(C)=O)C(=O)NCc1ccccc1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C(C)=O)C(=O)NC1CCCCC1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)cc1)C(C)=O)C(=O)NC1CCCCC1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)c(Cl)c1)C(C)=O)C(=O)NC1CCCCC1
CCCC(=O)N(Cc1ccccc1)C(C(=O)NC1CCCCC1)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C=O)C(=O)NC1CCCCC1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)cc1)C=O)C(=O)NC1CCCCC1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)cc1)C=O)C(=O)NC1CCCCC1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)cc1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)c(Cl)c1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)cc1Cl)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(Cl)nc1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(C=O)[C@H](C)c1ccc(Cl)cc1)C(=O)NC(C)(C)C |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(O)cc1)C=O)C(=O)NC(C)(C)C
CC(=O)N(Cc1ccccc1)C(C(=O)NC1CCCCC1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C=O)C(=O)NC1CCCCC1
CC(=O)N(Cc1ccc(Cl)cc1)C(C(=O)NC1CCCCC1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)c(Cl)c1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)cc1Cl)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(Cl)nc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
C[C@H](N(C=O)C(C(=O)NC(C)(C)C)c1c([nH]c2cc(Cl)ccc12)C(O)=O)c1ccc(Cl)cc1 |r|
C[C@@H](N(C=O)C(C(=O)NC(C)(C)C)c1c([nH]c2cc(Cl)ccc12)C(O)=O)c1ccc(Cl)cc1 |r|
CC(C)(C)NC(=O)C(N(Cc1ccc(O)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(cc1)-c1ccccc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(Oc2ccccc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)cc1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cccc(F)c1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)c(F)c1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)cc1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cccc(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)ccc1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)cc(F)c1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)cccc1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)cc1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)c(F)c1)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)ccc(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)cc(F)cc1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)cc(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)c(F)cc(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)cc(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1c(F)c(F)c(F)c(F)c1F)C=O)C(=O)NC(C)(C)C
CC(C)CN(C(C(=O)NCc1ccccc1)c1cn(C(=O)OC(C)(C)C)c2ccccc12)C(C)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(F)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCOC(=O)c1c(C(N(CC(C)C)C(C)=O)C(=O)NCc2ccccc2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
CCOC(=O)c1c(C(N(Cc2ccccc2)C(C)=O)C(=O)NCc2ccccc2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
CCOC(=O)c1c(C(N(Cc2ccccc2)C(C)=O)C(=O)NC2CCCCC2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
CC(C)(C)NC(=O)C(N(Cc1ccc(F)cc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1cccc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCCC(=O)N(Cc1ccccc1)C(C(=O)NC1CCCCC1)c1c(C(=O)OCC)n(C(=O)OC(C)(C)C)c2cc(Cl)ccc12
CCOC(=O)c1c(C(N(Cc2ccccc2)C=O)C(=O)NC2CCCCC2)c2ccc(Cl)cc2n1C(=O)OC(C)(C)C
CC(C)(C)NC(=O)C(N(Cc1c(F)cccc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1cc(F)c(F)cc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1cc(F)c(F)c(F)c1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1c(F)ccc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1c(F)cc(F)cc1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1cc(F)cc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1c(F)c(F)cc(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1c(F)cc(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1cc(F)c(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1c(F)c(F)c(F)c(F)c1F)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N[C@@H](C(C)C)C(=O)OC)C(=O)NCc1ccccc1 |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N[C@@H](CC(C)C)C(=O)OC)C(=O)NCc1ccccc1 |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N[C@@H](CC(C)C)C(=O)NCCN1CCOCC1)C(=O)NCc1ccccc1 |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N[C@H](CC(C)C)C(=O)NCC1CC1)C(=O)NCc1ccccc1 |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N[C@H](CC(C)C)C(=O)NCCO)C(=O)NCc1ccccc1 |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N[C@H](CC(C)C)C(=O)NCCCN1CCOCC1)C(=O)NCc1ccccc1 |r|
CC(C)CC(NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(=O)NO)C(=O)NO
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC(CC(C)C)C(O)=O)C(=O)NCc1ccccc1
CC(C)CC(NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O)C(=O)NCCN1CCOCC1
CC(CC(CN1CCOCC1)NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O)C=O
CC(C)CC(NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O)C(=O)NCCO
CC(C)CC(NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O)C(=O)NCCCN1CCOCC1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCc1ccccc1)C(=O)NC1CCCCC1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCc1ccccc1)C(=O)NC1CCCCC1
CC(C)(C)NC(=O)C(NCc1ccc(Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(=O)N(Cc1ccccc1)C(C(=O)NC1CCCCC1)c1c([nH]c2cc(Cl)ccc12)C(=O)NCCc1ccncc1
COCCNC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccccc1)C(C)=O)C(=O)NC1CCCCC1
CCCCNC(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:15.14,18.18,25.24,wD:8.8,27.29,(-6.4,5,;-6.8,3.51,;-8.29,3.11,;-8.69,1.62,;-10.17,1.22,;-10.57,-.26,;-12.06,-.66,;-9.48,-1.35,;-9.48,-2.89,;-10.82,-3.66,;-8.15,-3.66,;-6.61,-3.66,;-5.28,-2.89,;-5.28,-1.35,;-3.94,-3.66,;-2.61,-2.89,;-2.61,-1.35,;-1.28,-.58,;.06,-1.35,;1.39,-.58,;2.73,-1.35,;4.06,-.58,;4.06,.96,;5.39,-1.35,;6.73,-.58,;8.06,-1.35,;8.06,-2.89,;9.39,-3.66,;10.16,-5,;8.62,-5,;10.73,-2.89,;10.73,-1.35,;12.06,-.58,;12.06,-2.12,;9.39,-.58,;.06,-2.89,;-1.28,-3.66,)|
CCN(CC)C(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:15.14,18.18,25.24,wD:8.8,27.29,(-8.29,3.71,;-8.69,2.22,;-10.17,1.82,;-11.26,2.91,;-10.87,4.4,;-10.57,.33,;-12.06,-.06,;-9.48,-.75,;-9.48,-2.29,;-10.82,-3.06,;-8.15,-3.06,;-6.61,-3.06,;-5.28,-2.29,;-5.28,-.75,;-3.94,-3.06,;-2.61,-2.29,;-2.61,-.75,;-1.28,.02,;.06,-.75,;1.39,.02,;2.73,-.75,;4.06,.02,;4.06,1.56,;5.39,-.75,;6.73,.02,;8.06,-.75,;8.06,-2.29,;9.39,-3.06,;10.16,-4.4,;8.62,-4.4,;10.73,-2.29,;10.73,-.75,;12.06,.02,;12.06,-1.52,;9.39,.02,;.06,-2.29,;-1.28,-3.06,)|
C[C@H](OC(=O)NC(C)(C)C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:15.14,18.18,25.24,wD:1.0,27.29,(-10.82,-2.72,;-9.48,-1.95,;-9.48,-.41,;-10.57,.68,;-12.06,.28,;-10.17,2.17,;-8.69,2.57,;-8.29,4.05,;-7.6,1.48,;-7.2,2.96,;-8.15,-2.72,;-6.61,-2.72,;-5.28,-1.95,;-5.28,-.41,;-3.94,-2.72,;-2.61,-1.95,;-2.61,-.41,;-1.28,.36,;.06,-.41,;1.39,.36,;2.73,-.41,;4.06,.36,;4.06,1.9,;5.39,-.41,;6.73,.36,;8.06,-.41,;8.06,-1.95,;9.39,-2.72,;10.16,-4.05,;8.62,-4.05,;10.73,-1.95,;10.73,-.41,;12.06,.36,;12.06,-1.18,;9.39,.36,;.06,-1.95,;-1.28,-2.72,)|
CCCN(C)C(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:15.14,18.18,25.24,wD:8.8,27.29,(-6.8,4.25,;-8.29,3.85,;-8.69,2.37,;-10.17,1.97,;-11.26,3.06,;-10.57,.48,;-12.06,.08,;-9.48,-.61,;-9.48,-2.15,;-10.82,-2.92,;-8.15,-2.92,;-6.61,-2.92,;-5.28,-2.15,;-5.28,-.61,;-3.94,-2.92,;-2.61,-2.15,;-2.61,-.61,;-1.28,.16,;.06,-.61,;1.39,.16,;2.73,-.61,;4.06,.16,;4.06,1.7,;5.39,-.61,;6.73,.16,;8.06,-.61,;8.06,-2.15,;9.39,-2.92,;10.16,-4.25,;8.62,-4.25,;10.73,-2.15,;10.73,-.61,;12.06,.16,;12.06,-1.38,;9.39,.16,;.06,-2.15,;-1.28,-2.92,)|
COCCNC(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:15.14,18.18,25.24,wD:8.8,27.29,(-6.4,5,;-6.8,3.51,;-8.29,3.11,;-8.69,1.62,;-10.17,1.22,;-10.57,-.26,;-12.06,-.66,;-9.48,-1.35,;-9.48,-2.89,;-10.82,-3.66,;-8.15,-3.66,;-6.61,-3.66,;-5.28,-2.89,;-5.28,-1.35,;-3.94,-3.66,;-2.61,-2.89,;-2.61,-1.35,;-1.28,-.58,;.06,-1.35,;1.39,-.58,;2.73,-1.35,;4.06,-.58,;4.06,.96,;5.39,-1.35,;6.73,-.58,;8.06,-1.35,;8.06,-2.89,;9.39,-3.66,;10.16,-5,;8.62,-5,;10.73,-2.89,;10.73,-1.35,;12.06,-.58,;12.06,-2.12,;9.39,-.58,;.06,-2.89,;-1.28,-3.66,)|
CCCCN(C)C(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:16.15,19.19,26.25,wD:9.9,28.30,(-6.4,5,;-6.8,3.51,;-8.29,3.11,;-8.69,1.62,;-10.17,1.22,;-11.26,2.31,;-10.57,-.26,;-12.06,-.66,;-9.48,-1.35,;-9.48,-2.89,;-10.82,-3.66,;-8.15,-3.66,;-6.61,-3.66,;-5.28,-2.89,;-5.28,-1.35,;-3.94,-3.66,;-2.61,-2.89,;-2.61,-1.35,;-1.28,-.58,;.06,-1.35,;1.39,-.58,;2.73,-1.35,;4.06,-.58,;4.06,.96,;5.39,-1.35,;6.73,-.58,;8.06,-1.35,;8.06,-2.89,;9.39,-3.66,;10.16,-5,;8.62,-5,;10.73,-2.89,;10.73,-1.35,;12.06,-.58,;12.06,-2.12,;9.39,-.58,;.06,-2.89,;-1.28,-3.66,)|
CC(C)N(C)C(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:15.14,18.18,25.24,wD:8.8,27.29,(-8.29,4.05,;-8.69,2.57,;-7.6,1.48,;-10.17,2.17,;-11.26,3.26,;-10.57,.68,;-12.06,.28,;-9.48,-.41,;-9.48,-1.95,;-10.82,-2.72,;-8.15,-2.72,;-6.61,-2.72,;-5.28,-1.95,;-5.28,-.41,;-3.94,-2.72,;-2.61,-1.95,;-2.61,-.41,;-1.28,.36,;.06,-.41,;1.39,.36,;2.73,-.41,;4.06,.36,;4.06,1.9,;5.39,-.41,;6.73,.36,;8.06,-.41,;8.06,-1.95,;9.39,-2.72,;10.16,-4.05,;8.62,-4.05,;10.73,-1.95,;10.73,-.41,;12.06,.36,;12.06,-1.18,;9.39,.36,;.06,-1.95,;-1.28,-2.72,)|
C[C@H](OC(=O)N(C)C(C)(C)C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:16.15,19.19,26.25,wD:1.0,28.30,(-10.82,-2.72,;-9.48,-1.95,;-9.48,-.41,;-10.57,.68,;-12.06,.28,;-10.17,2.17,;-11.26,3.26,;-8.69,2.57,;-8.29,4.05,;-7.6,1.48,;-7.2,2.96,;-8.15,-2.72,;-6.61,-2.72,;-5.28,-1.95,;-5.28,-.41,;-3.94,-2.72,;-2.61,-1.95,;-2.61,-.41,;-1.28,.36,;.06,-.41,;1.39,.36,;2.73,-.41,;4.06,.36,;4.06,1.9,;5.39,-.41,;6.73,.36,;8.06,-.41,;8.06,-1.95,;9.39,-2.72,;10.16,-4.05,;8.62,-4.05,;10.73,-1.95,;10.73,-.41,;12.06,.36,;12.06,-1.18,;9.39,.36,;.06,-1.95,;-1.28,-2.72,)|
C[C@H](OC(=O)N(C)C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:13.12,16.16,23.22,wD:1.0,25.27,(-10.82,-2.32,;-9.48,-1.55,;-9.48,-.01,;-10.57,1.08,;-12.06,.68,;-10.17,2.57,;-8.69,2.96,;-11.26,3.65,;-8.15,-2.32,;-6.61,-2.32,;-5.28,-1.55,;-5.28,-.01,;-3.94,-2.32,;-2.61,-1.55,;-2.61,-.01,;-1.28,.76,;.06,-.01,;1.39,.76,;2.73,-.01,;4.06,.76,;4.06,2.3,;5.39,-.01,;6.73,.76,;8.06,-.01,;8.06,-1.55,;9.39,-2.32,;10.16,-3.65,;8.62,-3.65,;10.73,-1.55,;10.73,-.01,;12.06,.76,;12.06,-.78,;9.39,.76,;.06,-1.55,;-1.28,-2.32,)|
CNC(=O)O[C@@H](C)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:12.11,15.15,22.21,wD:5.5,24.26,(-8.69,3.31,;-10.17,2.91,;-10.57,1.42,;-12.06,1.02,;-9.48,.33,;-9.48,-1.21,;-10.82,-1.98,;-8.15,-1.98,;-6.61,-1.98,;-5.28,-1.21,;-5.28,.33,;-3.94,-1.98,;-2.61,-1.21,;-2.61,.33,;-1.28,1.1,;.06,.33,;1.39,1.1,;2.73,.33,;4.06,1.1,;4.06,2.64,;5.39,.33,;6.73,1.1,;8.06,.33,;8.06,-1.21,;9.39,-1.98,;10.16,-3.31,;8.62,-3.31,;10.73,-1.21,;10.73,.33,;12.06,1.1,;12.06,-.44,;9.39,1.1,;.06,-1.21,;-1.28,-1.98,)|
C[C@H](OC(N)=O)\C=C/C(=O)N[C@H]1CO[C@@H](C\C=C(/C)\C=C\[C@@H]2C[C@]3(CO3)CC(C)(C)O2)OC1 |r,wU:11.10,14.14,21.20,wD:1.0,23.25,(-10.82,-1.78,;-9.48,-1.01,;-9.48,.53,;-10.57,1.62,;-10.17,3.11,;-12.06,1.22,;-8.15,-1.78,;-6.61,-1.78,;-5.28,-1.01,;-5.28,.53,;-3.94,-1.78,;-2.61,-1.01,;-2.61,.53,;-1.28,1.3,;.06,.53,;1.39,1.3,;2.73,.53,;4.06,1.3,;4.06,2.84,;5.39,.53,;6.73,1.3,;8.06,.53,;8.06,-1.01,;9.39,-1.78,;10.16,-3.11,;8.62,-3.11,;10.73,-1.01,;10.73,.53,;12.06,1.3,;12.06,-.24,;9.39,1.3,;.06,-1.01,;-1.28,-1.78,)|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](C[C@H](C)C(F)(F)F)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](C[C@@H](C)C(F)(F)F)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](C[C@H](C)C(F)(F)F)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](C[C@@H](C)C(F)(F)F)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)CF)[C@]2(C1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)CF)[C@]2(C1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)CF)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
CCOC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](C[C@@H](C)C(F)(F)F)[C@]3(C2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)c(OC)c1 |r|
COC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC3(CF)CC3)C3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)c(OC)c1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC2(CF)CC2)C2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC2(CF)CC2)C2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC2(CF)CC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC2(CF)CC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCCO)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)COC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CC1)C(O)=O)c1ccc(Cl)cc1 |r|
C[C@H](N1C(=O)c2cc(ccc2[C@]1(OCC(C)(O)CO)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1 |r,w:14.18|
C[C@H](N1C(=O)c2cc(ccc2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1 |r|
C[C@](O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
C[C@@](O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
COC[C@](C)(O)c1ccc2c(c1)C(=O)N([C@@H](C)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
COC[C@@](C)(O)c1ccc2c(c1)C(=O)N([C@@H](C)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CN(C)C[C@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CN(C)C[C@@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N([C@@H](CC(O)=O)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
C[C@H](N1C(=O)c2cc(ccc2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(O)CO)c1ccc(Cl)cc1 |r|
CC(C)(O)CCO[C@]1(N(Cc2ccc(Cl)cc2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)C2(OCc1cn[nH]c1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CC1)C#N)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CNS(C)(=O)=O)CC1)c1ccc(Cl)cc1 |r|
CC(C)(c1ccc2c(c1)C(=O)N([C@]2(c3ccc(cc3)Cl)OCC4(CC4)CO)Cc5ccc(cc5)C#C)O
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cc3)C#C)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@](O)(CO)c1cc2C(=O)N(Cc3ccc(cc3)C#C)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(cc1)C#N)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(C)COC1)c1ccc(Cl)cc1 |r|
C[C@](O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(cc1)C#N)[C@]2(C)OCC1(CO)CC1 |r|
CC(O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(cc1)C#N)[C@]2(C)OCC1(CO)CC1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(O)CC1)c1ccc(Cl)cc1 |r|
CN(C)C(=O)CO[C@]1(N(Cc2ccc(Cl)cc2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1 |r|
COCC1(CO[C@]2(N(Cc3ccc(Cl)cc3)C(=O)c3cc(ccc23)C(C)(C)O)c2ccc(Cl)cc2)CC1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1C(O)=O)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1S(=O)(=O)N1CCOCC1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)C(OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1S(C)(=O)=O)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(O[C@@H]1CCOC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(O[C@H]1CCOC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OC[C@H]1CCOC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OC[C@@H]1CCOC1)c1ccc(Cl)cc1 |r|
C[C@@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@@](O)(CN1CCNCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@](O)(CN1CCNCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@H](N1C(=O)c2cc(ccc2[C@]1(OC1COC[C@H]1O)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1 |r|
C[C@H](N1C(=O)c2cc(ccc2[C@]1(OC1COC[C@@H]1O)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cc2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCCCO)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC(F)(F)CO)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OC[C@H]1CC[C@H]1CO)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OC[C@H]1CC[C@@H]1CO)c1ccc(Cl)cc1 |r|
CC(O)(C(=O)N1CCCC1)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CN(C)C(=O)[C@@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CN(C)C(=O)[C@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CNC(=O)[C@@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CNC(=O)[C@](C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CSc1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(C)O |r|
C[S@](=O)c1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(C)O |r|
C[S@@](=O)c1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(C)O |r|
COC[C@@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
COC[C@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@@](O)(CO)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@](O)(CO)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCN(C[C@](C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](O[C@@H]4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CN1CCN(C[C@@](C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](O[C@@H]4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CN1CCN(C[C@](C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](O[C@H]4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CN1CCN(C[C@@](C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](O[C@H]4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CC(C)(O)c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3CO)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)[C@@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)[C@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)[C@@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)[C@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCN(C[C@@](C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](OCC4(CO)CC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CN1CCN(C[C@](C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](OCC4(CO)CC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3C(O)=O)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCC(CC1)[C@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCC(CC1)[C@@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3P(C)(C)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CS(=O)(=O)c1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)[C@@H](O)C1CCOCC1 |r|
CS(=O)(=O)c1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)[C@H](O)C1CCOCC1 |r|
C[C@@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cc2C(O)=O)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@@](C)(O)C1CCOCC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@](C)(O)C1CCOCC1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cn(C)cn1)c1cc2C(=O)N([C@@H](CO)c3ccc(cc3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(c1cn(C)cn1)c1cc2C(=O)N([C@@H](CO)c3ccc(cc3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3CO)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3CO)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@](C)(O)C1(F)CCOCC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@@](C)(O)C1(F)CCOCC1)c1ccc(Cl)cc1 |r|
CCC(O)(c1ccn(C)n1)c1cc2C(=O)N([C@@H](CCC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC[C@@](O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@](C)(O)C1CCC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@@](C)(O)C1CCC1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N([C@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(C1CCOCC1)c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N([C@@H](CCC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(C1CCOCC1)c1cc2C(=O)N([C@@H](CCC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cc2C(=O)N([C@@H](CCC([O-])=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CCO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)[C@](O)(CC)C1(F)CCOCC1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cc2C(=O)N([C@@H](CCC(O)=O)c3ccc(OC)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CCC(O)([C@H]1CC[C@H](O)CC1)c1cc2C(=O)N([C@@H](CCC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:4.3,17.17,30.32,wD:7.7,(-5.91,-3.01,;-4.37,-3.01,;-3.6,-1.67,;-2.83,-3.01,;-4.93,-.9,;-6.27,-1.67,;-7.6,-.9,;-7.6,.64,;-8.93,1.41,;-6.27,1.41,;-4.93,.64,;-2.26,-.9,;-.93,-1.67,;.4,-.9,;1.87,-1.38,;2.27,-2.87,;2.77,-.13,;4.31,-.13,;5.08,1.2,;6.62,1.2,;7.39,2.53,;8.93,2.53,;6.62,3.87,;5.08,-1.47,;4.31,-2.8,;5.08,-4.13,;6.62,-4.13,;7.39,-5.47,;7.39,-2.8,;6.62,-1.47,;1.87,1.11,;1.1,2.45,;1.87,3.78,;.4,.64,;-.93,1.41,;-.93,2.95,;-2.26,.64,;2.96,2.2,;4.44,1.8,;5.53,2.89,;5.13,4.38,;6.22,5.47,;3.65,4.78,;2.56,3.69,)|
CC[C@@](O)(c1cc2C(=O)N(Cc3ccc(Cl)cc3OCC([O-])=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3C(O)=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3C(O)=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCO[C@]1(N(Cc2ccc(Cl)cc2C(O)=O)C(=O)c2cc(cc(F)c12)[C@](O)(CC)C1CCOCC1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cc2C(=O)N(Cc3ccc(C)cc3C(O)=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC[C@@](O)(c1cc2C(=O)N(Cc3ccc(OC)cc3C([O-])=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3C(C)(C)C([O-])=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3CC([O-])=O)C(OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3CC(O)=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N([C@@H]([C@H](C)C(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](C)(O)c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OCC3(F)COC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](C)(O)c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OCC3(F)COC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)c1ccccn1 |r|
CC[C@](O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)c1ccccn1 |r|
CCC(O)(c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCNCC1 |r|
CC[C@](O)(C1CCN(C)CC1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)C(O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:28.29,2.2,30.32,wD:2.11,(-5.52,-3.34,;-3.98,-3.34,;-3.21,-2,;-2.44,-3.34,;-4.55,-1.23,;-5.88,-2,;-7.21,-1.23,;-7.21,.31,;-8.55,1.08,;-5.88,1.08,;-4.55,.31,;-1.88,-1.23,;-.55,-2,;.79,-1.23,;2.25,-1.71,;2.65,-3.2,;3.16,-.46,;4.7,-.46,;5.47,-1.8,;4.7,-3.13,;5.47,-4.46,;7.04,-4.51,;7.78,-3.13,;7.01,-1.8,;7.81,-5.84,;8.58,-7.18,;2.25,.78,;1.16,1.87,;1.16,3.41,;2.25,4.5,;1.16,5.59,;1.16,7.13,;.07,4.5,;.79,.31,;-.55,1.08,;-.55,2.62,;-1.88,.31,;3.59,1.55,;4.92,.78,;6.25,1.55,;6.25,3.09,;7.59,3.86,;4.92,3.86,;3.59,3.09,)|
CCC(O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCN(C)CC1 |r|
CC[C@](O)(C1CCN(CC(=O)OC(C)(C)C)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(C1CCN(CC(=O)OC(C)(C)C)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@@](O)(C1CCN(CC(O)=O)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(CC(O)=O)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(CCC(=O)OC)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(CCC(O)=O)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)C(OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@@H]4[C@@H]([C@@H](c5cccc(Cl)c5F)[C@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2nn3[C@@H]4[C@H](COc3c2c1)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
OC(=O)c1ccc2nn3[C@H]4[C@@H](COc3c2c1)N(CC1CC1)[C@@]1([C@@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
COc1cc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2cc1C(O)=O |r|
COc1cc2c3OC[C@@H]4[C@@H]([C@@H](c5cccc(Cl)c5F)[C@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2cc1C(O)=O |r|
COc1cc2nn3[C@@H]4[C@H](COc3c2cc1C(O)=O)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
COc1cc2nn3[C@H]4[C@@H](COc3c2cc1C(O)=O)N(CC1CC1)[C@@]1([C@@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
CS(=O)(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
CS(=O)(=O)c1ccc2c3OC[C@@H]4[C@@H]([C@@H](c5cccc(Cl)c5F)[C@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
COc1cc2nn3[C@@H]4[C@H](COc3c2cc1C#N)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
C[C@H]1Oc2n(nc3cc(ccc23)C(O)=O)[C@@H]2[C@H]1N(CC1CC1)[C@]1([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
C[C@H]1Oc2n(nc3cc(ccc23)C(O)=O)[C@H]2[C@@H]1N(CC1CC1)[C@@]1([C@@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
C[C@@H]1Oc2n(nc3cc(ccc23)C(O)=O)[C@@H]2[C@H]1N(CC1CC1)[C@]1([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
C[C@@H]1Oc2n(nc3cc(ccc23)C(O)=O)[C@H]2[C@@H]1N(CC1CC1)[C@@]1([C@@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
CC(C)(C)CN1[C@H]2COc3n(nc4cc(ccc34)C(O)=O)[C@H]2[C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CCC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
CC(C)CN1[C@H]2COc3n(nc4cc(ccc34)C(O)=O)[C@H]2[C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12 |r|
CC(C)CN1[C@@H]2COc3n(nc4cc(ccc34)C(O)=O)[C@@H]2[C@@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12 |r|
CC(C)CCN1[C@H]2COc3n(nc4cc(ccc34)C(O)=O)[C@H]2[C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12 |r|
[#6]\[#6](-[#6])=[#6]/[#6]-[#7]1-[#6@H]-2-[#6]-[#8]-c3n(nc4cc(ccc34)-[#6](-[#8])=O)-[#6@H]-2-[#6@H](-c2cccc(Cl)c2F)[C@]11[#6](=O)-[#7]-c2cc(Cl)ccc12 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
CC1CC1CN1[C@H]2COc3n(nc4cc(ccc34)C(O)=O)[C@H]2[C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4(F)F)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CCCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CCOC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CCCCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4C4CCCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
C[C@H]1CC(C[C@@H]1C)N1[C@H]2COc3n(nc4cc(ccc34)C(O)=O)[C@H]2[C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4C4CCCCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4C4CCCCCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CCCOC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CCOCC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
CCOc1cccc(CN2[C@H]3COc4n(nc5cc(ccc45)C(O)=O)[C@H]3[C@H](c3cccc(Cl)c3F)[C@]22C(=O)Nc3cc(Cl)ccc23)c1 |r|
CCOc1cccc(CN2[C@@H]3COc4n(nc5cc(ccc45)C(O)=O)[C@@H]3[C@@H](c3cccc(Cl)c3F)[C@@]22C(=O)Nc3cc(Cl)ccc23)c1 |r|
CCOc1cccc(CN2[C@H]3COc4n(nc5ccc(cc45)C(O)=O)[C@H]3[C@H](c3cccc(Cl)c3F)[C@]22C(=O)Nc3cc(Cl)ccc23)c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Br)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cc(Cl)cc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5ccc(F)c(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5ccnc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cc(Cl)nc(Cl)c5)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4nc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1ccc2c3OCC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
COc1cc2c3OCC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2cc1C(O)=O |r|
OC(=O)c1ccc2nn3[C@@H]4[C@H](CCOc3c2c1)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
NC(=O)c1ccc2nn3[C@@H]4[C@H](COc3c2c1)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
CCN(CC)C(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
NC(=O)c1ccc2c3OC[C@H]4[C@H]([C@H](c5ccnc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2c1 |r|
OC(=O)c1cc2c3OC[C@H]4[C@H]([C@H](c5cccc(Cl)c5F)[C@@]5(N4CC4CC4)C(=O)Nc4cc(Cl)ccc54)n3nc2cc1F |r|
OC(=O)c1cc2nn3[C@@H]4[C@H](COc3c2cc1F)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
Cc1c(ccc2nn3[C@@H]4[C@H](COc3c12)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12)C(O)=O |r|
Cc1c(ccc2nn3[C@H]4[C@@H](COc3c12)N(CC1CC1)[C@@]1([C@@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12)C(O)=O |r|
Cc1cc2nn3[C@@H]4[C@H](COc3c2cc1C(O)=O)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
OC(=O)c1cnc2nn3[C@@H]4[C@H](COc3c2c1)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
OC(=O)c1cnc2nn3[C@H]4[C@@H](COc3c2c1)N(CC1CC1)[C@@]1([C@@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
Cc1cc2nn3[C@@H]4[C@H](CCOc3c2cc1C(O)=O)N(CC1CC1)[C@]1([C@H]4c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc12 |r|
CC(O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
COCC(C)(O)c1ccc2c(c1)C(=O)N([C@@H](C)c1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CN(C)CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCc1cn[nH]c1)c1ccc(Cl)cc1 |r|
CCC1(CO[C@]2(N(Cc3ccc(Cl)cc3)C(=O)c3cc(ccc23)C(C)(C)O)c2ccc(Cl)cc2)CC1 |r|
CC(O)(CO)c1cc2C(=O)N(Cc3ccc(cc3)C#C)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(cc1)C#N)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OC1CCOC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1CCOC1)c1ccc(Cl)cc1 |r|
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(CN1CCNCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[C@H](N1C(=O)c2cc(ccc2[C@]1(O[C@@H]1COC[C@@H]1O)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1 |r|
CN(C)C(=O)C(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CNC(=O)C(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1 |r|
CS(=O)c1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(C)O |r|
COCC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(CO)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](OC4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](O[C@H]4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](OCC4(CO)CC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CN1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CS(=O)(=O)c1cc(Cl)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(O)C1CCOCC1 |r|
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3S(C)(=O)=O)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCOCC1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)C(C)(O)C1(F)CCOCC1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CCC(C)(O)c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OCC3(F)COC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)c1ccccn1 |r|
CC[C@](O)(C1CCN(CCC(O)=O)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3CO)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cc3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1(CO)CCC1)c1ccc(Cl)cc1 |r|
CCO[C@]1(N(Cc2ccc(Cl)cc2C([O-])=O)C(=O)c2cc(cc(F)c12)[C@](O)(CC)C1CCOCC1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cc3CC([O-])=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCOCC1)c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N([C@@H](CO)c3ccc(cc3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(C)C(=O)C1)c1ccc(Cl)cc1 |r|
CO[C@]1(N([C@@H](CC(O)=O)c2ccc(Cl)cc2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCC1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC[C@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:19.20,24.25,wD:22.22,(-6.55,-1.33,;-5.21,-2.1,;-5.21,-.56,;-5.21,-3.64,;-3.88,-1.33,;-2.55,-2.1,;-1.21,-1.33,;.25,-1.8,;.73,-3.27,;1.16,-.56,;2.7,-.56,;3.47,-1.89,;2.7,-3.23,;3.47,-4.56,;5.04,-4.61,;5.78,-3.23,;5.01,-1.89,;5.81,-5.94,;6.58,-7.27,;.25,.69,;-.52,2.02,;-.12,3.51,;-1.21,4.6,;-1.21,6.14,;-2.75,6.14,;-3.84,7.23,;-2.75,4.6,;-1.21,.21,;-2.55,.98,;-2.55,2.52,;-3.88,.21,;1.59,1.46,;2.92,.69,;4.25,1.46,;4.25,3,;5.59,3.77,;2.92,3.77,;1.59,3,)|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)C1CCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CC[C@H](O)C1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCCNCC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCNC(=O)C1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN(C)C1CCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCC(O)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(CCO)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CNC1CCOCC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)Cn1ccnc1)c1ccc(Cl)cc1 |r|
C[C@@H](CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1)C(N)=O |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN(C)C1CCN(CC1)C(C)=O)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCS(=O)(=O)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCC[C@H]1CO)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1ccccn1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCCC1=O)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCC(N)CC1)c1ccc(Cl)cc1 |r|
Cc1nc(cn1C)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCNC(=O)CC1)c1ccc(Cl)cc1 |r|
C[C@H](N1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CO)CC1)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(cn1)C#N |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCn2nncc2C1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)COc1cccnc1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1C[C@H]2C[C@@H]1CN2C)c1ccc(Cl)cc1 |r|
CCOCC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OC)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)COC1CCNCC1)c1ccc(Cl)cc1 |r|
CC(=O)N1CCC(CC1)C(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)C2(O)c1ccc(Cl)cc1 |w:29.33|
CC(=O)N1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCC[C@@H]1CO)c1ccc(Cl)cc1 |r|
CC(O)(C1CCNCC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(=O)N1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
C[S+]([O-])C1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCC1)c1ccc(Cl)cc1 |r|
C[C@H](CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1)C(N)=O |r|
Cn1cc(cn1)C(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(C)[C@@H](C)C1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(C)C[C@@H]1C)c1ccc(Cl)cc1 |r|
CC(O)(c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1)c1ccccn1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(C)[C@H](C)C1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CNC(=O)C(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OC)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(cn2)C#N)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1 |r|
CCNC(=O)C(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OC)c1ccc(Cl)cc1 |r|
CC(O)C1(CO[C@]2(N(Cc3ccc(cn3)C#N)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1 |r|
CN1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)C(=O)NC(C)C)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cc2C(=O)N([C@@H](CC(O)=O)c3ccc(Cl)cc3)C(OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCN(C)CC1 |r|
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1cn(C)c(C)n1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CN(C)C1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1ccn(C)n1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:23.25,25.26,27.29,(-7.24,1.34,;-6.61,-.07,;-5.1,-.39,;-4.94,-1.92,;-6.35,-2.55,;-7.38,-1.4,;-3.61,-2.69,;-4.38,-4.03,;-2.84,-4.03,;-2.28,-1.92,;-.94,-2.69,;.39,-1.92,;1.86,-2.4,;2.33,-3.86,;2.76,-1.15,;4.3,-1.15,;5.07,-2.49,;4.3,-3.82,;5.07,-5.15,;6.61,-5.15,;7.38,-6.49,;7.38,-3.82,;6.61,-2.49,;1.86,.09,;1.05,1.41,;1.45,2.9,;2.78,3.67,;2.01,5,;2.41,6.49,;.68,4.23,;.39,-.38,;-.94,.39,;-.94,1.93,;-2.28,-.38,;2.94,1.18,;4.43,.78,;5.52,1.87,;5.12,3.36,;6.21,4.45,;3.63,3.76,;2.55,2.67,)|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:23.25,25.26,wD:27.29,(-7.24,1.34,;-6.61,-.07,;-5.1,-.39,;-4.94,-1.92,;-6.35,-2.55,;-7.38,-1.4,;-3.61,-2.69,;-4.38,-4.03,;-2.84,-4.03,;-2.28,-1.92,;-.94,-2.69,;.39,-1.92,;1.86,-2.4,;2.33,-3.86,;2.76,-1.15,;4.3,-1.15,;5.07,-2.49,;4.3,-3.82,;5.07,-5.15,;6.61,-5.15,;7.38,-6.49,;7.38,-3.82,;6.61,-2.49,;1.86,.09,;1.05,1.41,;1.45,2.9,;.68,4.23,;2.01,5,;2.41,6.49,;2.78,3.67,;.39,-.38,;-.94,.39,;-.94,1.93,;-2.28,-.38,;2.94,1.18,;4.43,.78,;5.52,1.87,;5.12,3.36,;6.21,4.45,;3.63,3.76,;2.55,2.67,)|
COc1nc(C)ccc1CN1C(=O)c2cc(cc(F)c2[C@]1(OC)c1ccc(Cl)cc1)C(C)(C)O |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1ncc[nH]1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1nccs1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)C(=O)CN(C)C)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1cnn(CCN(C)C)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)c1ncccn1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)C(C)=N)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(F)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1cn(C)nn1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)S(C)(=O)=O)c1ccc(Cl)cc1 |r|
Cc1nc(cn1C)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(c1cscn1)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(COCC(O)=O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)C(=O)c1ncco1)c1ccc(Cl)cc1 |r|
CN(C)CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(=O)NCC1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCS(=O)(=O)CC1)c1ccc(Cl)cc1 |r|
COc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(OCC2(CC2)C(N)=O)c2ccc(Cl)cc2)C(C)(O)c2cnn(C)c2)cn1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1cnn(c1)C1CN(C1)C(C)=O)c1ccc(Cl)cc1 |r|
CCOCC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
COCC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(CN1CCCC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(cn4)C#N)[C@](OCC4(CC4)C#N)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
Cn1cnc(c1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
COc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(OCC2(CO)CC2)c2ccc(Cl)cc2)C(C)(O)c2cnn(C)c2)cn1 |r|
C[C@@H](O)CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)c1cnn(C)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
COc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(OCC2(CO)CC2)c2ccc(Cl)cc2)C(C)(O)c2cnn(C)c2)nc1 |r|
Cc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(OCC2(O)CC2)c2ccc(Cl)cc2)C(C)(O)c2cnn(C)c2)nc1 |r|
CC(C)(O)c1cc2C(=O)N([C@@H](C=C)c3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ncc(Cl)cc2S(C)(=O)=O)C(=O)c2cc(cc(F)c12)C(C)(O)c1cnn(C)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(cn2)C#N)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)C(C)=O)c1ccc(Cl)cc1 |r|
COc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(OCC2(O)CC2)c2ccc(Cl)cc2)C(C)(O)c2cnn(C)c2)cn1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(F)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cc1nnc(o1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(C1CCS(=O)(=O)CC1)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CNC(=O)CNCC1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1 |r|
CC(O)(c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC(=O)N1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CN(C1)C(C)=O)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CN(C1)C(=O)CO)c1ccc(Cl)cc1 |r|
CC(O)(C1CCC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N([C@@H](CO)c3ccc(Cl)cn3)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)c[n+]3[O-])[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)c[n+]3[O-])[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1)c1ncccn1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(=O)N1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(C1CCC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:24.26,26.27,28.30,(-7.77,1.92,;-7,.59,;-5.49,.27,;-5.33,-1.27,;-6.74,-1.89,;-7.77,-.75,;-3.99,-2.04,;-3.99,-.5,;-3.99,-3.58,;-2.66,-1.27,;-1.33,-2.04,;.01,-1.27,;1.47,-1.74,;1.95,-3.21,;2.38,-.5,;3.92,-.5,;4.69,-1.83,;3.92,-3.16,;4.69,-4.5,;6.23,-4.5,;7,-3.16,;6.23,-1.83,;7,-5.83,;7.77,-7.16,;1.47,.75,;.7,2.08,;1.1,3.57,;2.43,4.34,;1.66,5.68,;2.06,7.16,;.33,4.91,;.01,.27,;-1.33,1.04,;-1.33,2.58,;-2.66,.27,;2.8,1.52,;4.14,.75,;5.47,1.52,;5.47,3.06,;6.81,3.83,;4.14,3.83,;2.8,3.06,)|
CCC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(C=C)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(C1CCS(=O)(=O)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CN1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1)C(F)(F)F |r|
CC(O)(C1CC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(cn2)C#N)C(=O)c2cc(cc(F)c12)C(C)(O)C1CN(C1)C(=O)N(C)C)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(O)(C=C)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:25.27,27.28,29.31,(-7.77,1.92,;-7,.59,;-5.49,.27,;-5.33,-1.27,;-6.74,-1.89,;-7.77,-.75,;-3.99,-2.04,;-3.99,-3.58,;-3.99,-.5,;-4.76,.84,;-2.66,-1.27,;-1.33,-2.04,;.01,-1.27,;1.47,-1.74,;1.95,-3.21,;2.38,-.5,;3.92,-.5,;4.69,-1.83,;3.92,-3.16,;4.69,-4.5,;6.23,-4.5,;7,-3.16,;6.23,-1.83,;7,-5.83,;7.77,-7.16,;1.47,.75,;.7,2.08,;1.1,3.57,;2.43,4.34,;1.66,5.68,;2.06,7.16,;.33,4.91,;.01,.27,;-1.33,1.04,;-1.33,2.58,;-2.66,.27,;2.8,1.52,;4.14,.75,;5.47,1.52,;5.47,3.06,;6.81,3.83,;4.14,3.83,;2.8,3.06,)|
CC(=O)N1CCC(CC1)C(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:26.28,28.29,30.32,(-8.83,-.48,;-7.5,.29,;-7.5,1.83,;-6.16,-.48,;-4.83,.29,;-3.49,-.48,;-3.49,-2.02,;-4.83,-2.79,;-6.16,-2.02,;-2.16,-2.79,;-2.16,-1.25,;-2.16,-4.33,;-.83,-2.02,;.51,-2.79,;1.84,-2.02,;3.3,-2.5,;3.78,-3.96,;4.21,-1.25,;5.75,-1.25,;6.52,-2.58,;5.75,-3.92,;6.52,-5.25,;8.06,-5.25,;8.83,-6.59,;8.83,-3.92,;8.06,-2.58,;3.3,-.01,;2.53,1.33,;2.53,2.87,;3.62,3.96,;2.53,5.05,;2.53,6.59,;1.45,3.96,;1.84,-.48,;.51,.29,;.51,1.83,;-.83,-.48,;4.64,.76,;5.97,-.01,;7.31,.76,;7.31,2.3,;8.64,3.07,;5.97,3.07,;4.64,2.3,)|
OC(C1CCS(=O)(=O)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cscn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)([C@H]1CC[C@H](O)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:24.26,6.6,wD:3.2,(-3.92,-3.92,;-2.83,-2.83,;-1.74,-3.92,;-4.16,-2.06,;-4.16,-.52,;-5.5,.25,;-6.83,-.52,;-8.16,.25,;-6.83,-2.06,;-5.5,-2.83,;-1.49,-2.06,;-.16,-2.83,;1.17,-2.06,;2.64,-2.54,;3.11,-4,;3.54,-1.29,;5.08,-1.29,;5.85,-2.62,;5.08,-3.96,;5.85,-5.29,;7.39,-5.29,;8.16,-6.62,;8.16,-3.96,;7.39,-2.62,;2.64,-.04,;1.87,1.29,;2.64,2.62,;1.87,3.96,;2.64,5.29,;1.87,6.62,;.53,4.73,;.53,3.19,;1.17,-.52,;-.16,.25,;-.16,1.79,;-1.49,-.52,;3.97,.73,;5.3,-.04,;6.64,.73,;6.64,2.27,;7.97,3.04,;5.3,3.04,;3.97,2.27,)|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(Cl)nc3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1ccn(C)c(=O)c1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cnn(C)c1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:25.27,27.28,29.31,(-3.23,-4.78,;-2.46,-3.45,;-3.23,-2.11,;-4.32,-3.2,;-4.56,-1.34,;-4.72,.19,;-6.23,.51,;-7,-.83,;-8.53,-.99,;-5.97,-1.97,;-1.9,-1.34,;-.56,-2.11,;.77,-1.34,;2.24,-1.82,;2.71,-3.28,;3.14,-.57,;4.68,-.57,;5.45,-1.91,;4.68,-3.24,;5.45,-4.58,;7.02,-4.62,;7.76,-3.24,;6.99,-1.91,;7.79,-5.96,;8.56,-7.29,;2.24,.67,;1.43,1.98,;1.43,3.52,;2.52,4.61,;1.43,5.7,;1.43,7.24,;.34,4.61,;.77,.2,;-.56,.97,;-.56,2.51,;-1.9,.2,;3.33,1.76,;4.81,1.36,;5.9,2.45,;5.5,3.94,;6.59,5.03,;4.02,4.34,;2.93,3.25,)|
Cn1cnc(c1)C(O)(C1CC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC[C@@H](C)O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cc(cn1)C(O)(CF)c1ccc2c(c1)C(=O)N(Cc1ccc(cn1)C#N)[C@@]2(O[C@H]1CCOC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)C(=O)NC1CCN(C)CC1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)C(=O)Nc1cnn(C)c1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)C(=O)NC1CN(C)C1)c1ccc(Cl)cc1 |r|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC(O)=O)CC1)c1ccc(Cl)cc1 |r|
Cc1cnc(CN2C(=O)c3cc(ccc3[C@]2(OCC2(CO)CC2)c2ccc(Cl)cc2)C(C)(C)O)cn1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OC3CCC(O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:24.26,wD:26.27,28.30,(-3.61,-5.11,;-2.84,-3.77,;-3.61,-2.44,;-4.38,-3.77,;-4.94,-1.67,;-5.1,-.14,;-6.61,.18,;-7.38,1.52,;-7.38,-1.15,;-6.35,-2.3,;-2.28,-1.67,;-.94,-2.44,;.39,-1.67,;1.86,-2.14,;2.33,-3.61,;2.76,-.9,;4.3,-.9,;5.07,-2.23,;4.3,-3.57,;5.07,-4.9,;6.61,-4.9,;7.38,-6.23,;7.38,-3.57,;6.61,-2.23,;1.86,.35,;1.09,1.68,;1.86,3.01,;1.46,4.5,;2.94,4.9,;3.71,6.23,;3.34,3.41,;.39,-.13,;-.94,.64,;-.94,2.18,;-2.28,-.13,;3.19,1.12,;4.52,.35,;5.86,1.12,;5.86,2.66,;7.19,3.43,;4.52,3.43,;3.19,2.66,)|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC(=C)CO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Cn1cnc(c1)C(C)(O)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OCC3(F)COC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OCC3(F)COC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](O[C@H]3C[C@H](CO)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:25.27,29.31,wD:27.28,(-6.3,-3.91,;-4.76,-3.91,;-3.99,-2.58,;-3.22,-3.91,;-5.33,-1.81,;-5.49,-.28,;-7,.04,;-7.77,1.38,;-7.77,-1.29,;-6.74,-2.44,;-2.66,-1.81,;-1.33,-2.58,;.01,-1.81,;1.47,-2.29,;1.95,-3.75,;2.38,-1.04,;3.92,-1.04,;4.69,-2.37,;3.92,-3.71,;4.69,-5.04,;6.23,-5.04,;7,-3.71,;6.23,-2.37,;7,-6.37,;7.77,-7.71,;1.47,.21,;.7,1.54,;1.1,3.03,;2.43,3.8,;1.66,5.13,;2.06,6.62,;.97,7.71,;.33,4.36,;.01,-.27,;-1.33,.5,;-1.33,2.04,;-2.66,-.27,;2.8,.98,;4.14,.21,;5.47,.98,;5.47,2.52,;6.81,3.29,;4.14,3.29,;2.8,2.52,)|
CC(O)(c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC(O)([C@H]1CC[C@H](O)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:24.26,6.6,26.27,28.30,wD:3.2,(-3.6,-4.11,;-2.83,-2.78,;-2.06,-4.11,;-4.16,-2.01,;-4.16,-.47,;-5.5,.3,;-6.83,-.47,;-8.16,.3,;-6.83,-2.01,;-5.5,-2.78,;-1.49,-2.01,;-.16,-2.78,;1.17,-2.01,;2.64,-2.48,;3.11,-3.95,;3.54,-1.24,;5.08,-1.24,;5.85,-2.57,;5.08,-3.91,;5.85,-5.24,;7.39,-5.24,;8.16,-6.57,;8.16,-3.91,;7.39,-2.57,;2.64,.01,;2.24,1.49,;2.64,2.98,;3.97,3.75,;3.2,5.09,;3.6,6.57,;1.87,4.32,;1.17,-.47,;-.16,.3,;-.16,1.84,;-1.49,-.47,;3.97,.78,;5.3,.01,;6.64,.78,;6.64,2.32,;7.97,3.09,;5.3,3.09,;3.97,2.32,)|
CC[C@@](O)(c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC[C@@](O)(c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CCC(O)([C@H]1CC[C@H](O)CC1)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OC[C@@H](C)O)(c2c(F)c1)c1ccc(Cl)cc1 |r,wU:4.3,26.28,29.32,wD:7.7,(-5.52,-2.86,;-3.98,-2.86,;-3.21,-1.53,;-2.44,-2.86,;-4.55,-.76,;-5.88,-1.53,;-7.21,-.76,;-7.21,.78,;-8.55,1.55,;-5.88,1.55,;-4.55,.78,;-1.88,-.76,;-.55,-1.53,;.79,-.76,;2.25,-1.23,;2.73,-2.7,;3.16,.01,;4.7,.01,;5.47,-1.32,;4.7,-2.65,;5.47,-3.99,;7.04,-4.04,;7.78,-2.65,;7.01,-1.32,;7.81,-5.37,;8.58,-6.7,;2.25,1.26,;1.48,2.59,;1.88,4.08,;.79,5.17,;-.7,4.77,;1.19,6.66,;.79,.78,;-.55,1.55,;-.55,3.09,;-1.88,.78,;3.59,2.03,;4.92,1.26,;6.25,2.03,;6.25,3.57,;7.59,4.34,;4.92,4.34,;3.59,3.57,)|
CCC(O)(CN1CCNCC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(CN1CC[C@@H](O)C1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(CN(C)C)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(CN1CCNCC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(CN1CCN(C)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(CN1CCN(C)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(CN1CCN(C)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(C)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(C)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(C)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OC[C@@H](C)O)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC[C@](O)(C1CCN(CCO)CC1)c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(C)(O)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(C)(O)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CCC(O)(c1cn(C)cn1)c1cc2C(=O)N(Cc3ncc(Cl)cc3OC)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1 |r|
CC(O)(c1cc2C(=O)N(Cc3ncc(Cl)cn3)[C@](OCCO)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CC[C@@](O)(c1cc2C(=O)N(Cc3ccc(C)nc3C(O)=O)[C@](OC)(c2c(F)c1)c1ccc(Cl)cc1)C1(F)CCOCC1 |r|
CCC(O)(c1ccn(C)n1)c1cc2C(=O)N(Cc3ncc(cn3)C#N)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1 |r|
Nc1cc(cnc1N1CCN(CC(O)=O)CC1c1ccc(Cl)cc1)C(F)(F)F
CC(=O)Nc1cc(cnc1N1CCN(CC(O)=O)CC1c1ccc(Cl)cc1)C(F)(F)F
Nc1cc(ccc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CC(O)=O)C(F)(F)F
Cc1cc(Cl)ccc1C1CN(CCN1c1ncc(Cl)cc1N)C(=O)CC(O)=O
Nc1cc(cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CC(O)=O)C(F)(F)F
CC1CN(C(CN1C(=O)CC(O)=O)c1ccc(Cl)cc1)c1ncc(Cl)cc1N
Nc1cc(Cl)ccc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CC(O)=O
CC(C)C1CN(C(CN1C(=O)CC(O)=O)c1ccc(Cl)cc1)c1ncc(Cl)cc1N
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CN1CCNCC1
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CCC(O)=O
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)NCC(O)=O
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)C1CNCCN1
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)c1cnccc1C(O)=O
CC(C)CC1CN(C(CN1C(=O)CC(O)=O)c1ccc(Cl)cc1)c1ncc(Cl)cc1N
C[C@H]1CN(C[C@H](N1c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
CC[C@H]1CN(C[C@H](N1c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CCCC(O)=O
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)C1CC1C(O)=O
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)[C@H]1CCC1C(O)=O |r|
OC(=O)CC(=O)N1C[C@H](C2CC2)N([C@@H](C1)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r|
CC(C)C[C@H]1CN(C[C@H](N1c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
CNC(=O)CC(=O)N1CCN(C(C1)c1ccc(Cl)cc1)c1ncc(Cl)cc1N
CNC(=O)CN1CCN(C(C1)c1ccc(Cl)cc1)c1ncc(Cl)cc1N
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)C1CC[C@@H]1C(O)=O |r|
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)C1CC(C1)C(O)=O |(-4.67,-3.21,;-3.33,-3.98,;-3.33,-5.52,;-2,-6.29,;-2,-7.83,;-.67,-5.52,;-.67,-3.98,;-2,-3.21,;-2,-1.67,;-3.33,-.9,;-3.33,.64,;-2,1.41,;-.67,.64,;-.67,-.9,;.67,-1.67,;.67,-3.21,;2,-3.98,;3.33,-3.21,;4.67,-3.98,;3.33,-1.67,;2,-.9,;-2,2.95,;-3.33,3.72,;-.67,3.72,;.87,3.72,;.87,5.26,;-.67,5.26,;1.96,6.35,;3.45,5.95,;1.56,7.83,)|
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)c1cccc(c1)C(O)=O
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)c1ccc(cc1)C(O)=O
CC(C)C[C@H]1CN(CC(N1c1ncc(Cl)cc1N)c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
CC(C)(C)C[C@H]1CN(C[C@H](N1c1ncc(Cl)cc1N)c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
Nc1cc(Cl)cnc1N1[C@@H](CC2CCCC2)CN(C[C@H]1c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)CC(O)=O
Nc1cc(Cl)cnc1N1CCN(CC1c1ccc(Cl)cc1)C(=O)C1C[C@@H]1C(O)=O |r|
CC(C)C[C@H]1CN(C[C@H](N1c1ncc(Cl)cc1N)c1ccc(Cl)cc1)C(=O)CC(O)=O |r|
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2ccc3OCOc3c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc3scnc3c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc3ncsc3c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2ccc3OC(F)(F)Oc3c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc3OCOc3c(F)c2)c(OC)n1
COc1ncc(-c2nc3C(=O)N(c4ccc5OCOc5c4)[C@@](C)(c3n2C(C)C)c2ccc(Cl)cc2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c4ccc(Cl)s4)c3n2C(C)C)c2ccc3OCOc3c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c4ccc(Cl)s4)c3n2C(C)C)c2cc3OCOc3cc2F)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@H](c4ccc(Cl)s4)c3n2C(C)C)c2cc3OCOc3cc2Cl)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc3OCOc3c(Cl)c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc3OCOc3c(C)c2)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cn3cnnc23)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N([C@@H](c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cn3ccnc23)c(OC)n1 |r|
COc1ncc(-c2nc3C(=O)N(C(c3n2C(C)C)c2ccc(Cl)cc2)c2cc(Cl)cc3[nH]ncc23)c(OC)n1
C[C@H](N1C(=O)c2cc(ccc2[C@]1(OCC(C)(O)CO)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(cc2)C#N)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cc2S(C)(=O)=O)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
C[C@H](N1C(=O)c2cc(ccc2[C@]1(O[C@H]1COC[C@H]1O)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cc1)[C@@]2(OCC1CCC1CO)c1ccc(Cl)cc1
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cc4S(C)(=O)=O)[C@](O[C@@H]4CCOC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1 |r|
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCCO)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCCCO)c1ccc(Cl)cc1
CC(C)(O)CCO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(O)CC1)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCCS(C)(=O)=O)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1
CCc1ccc(cc1)[C@]1(OCC2(CO)CC2)N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1F
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)c[n+]1[O-])[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(O[C@@H]1CC[C@@H](O)C1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(O[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(O[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(cn2)C#N)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(O[C@H]1CC[C@@H](O)C1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(O[C@@H]1CC[C@H](O)C1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(O[C@H]1CC[C@H](O)C1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(CC#N)CC1)c1ccc(Cl)cc1
CC(C)(c1cc2c(c(c1)F)[C@@](N(C2=O)Cc3ccc(cn3)Cl)(c4ccc(cc4)Cl)OCC5(CC5)O)O
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(C)nn2)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)S(C)(=O)=O)(c2c(F)c1)c1ccc(Cl)cc1
COC1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(cc1)C#N
CC(=O)N1CC(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(ccc23)C(C)(C)O)c2ccc(Cl)cc2)C1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1CCC1)c1ccc(Cl)cc1
CC(=O)NC1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)CO)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1
CC(O)(CO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(Cl)c12)C(C)(C)O)c1ccc(Cl)cc1
C[C@@H](CO)CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(c1cc2c(c(c1)F)[C@@](N(C2=O)Cc3ccc(cn3)Cl)(c4ccc(cc4)Cl)OCC5(CC5)C(=O)N)O
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(F)cc1
C[C@H](CO)CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC(O)(CCO)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(CO)CC1)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OC1CC(CO)C1)c1ccc(Cl)cc1 |wU:21.24,(-5.71,-4.05,;-5.71,-2.51,;-7.04,-1.74,;-7.04,-3.28,;-4.38,-1.74,;-4.38,-.2,;-3.04,.57,;-1.71,-.2,;-1.71,-1.74,;-3.04,-2.51,;-.25,-2.21,;.23,-3.68,;.66,-.97,;2.2,-.97,;2.97,-2.3,;4.51,-2.3,;5.28,-3.64,;4.51,-4.97,;5.28,-6.3,;2.97,-4.97,;2.2,-3.64,;-.25,.28,;.9,1.31,;2.36,.83,;3.74,1.53,;4.44,.16,;5.9,-.32,;7.04,.71,;3.06,-.54,;-.57,1.78,;-2.03,2.26,;-2.35,3.77,;-1.21,4.8,;-1.53,6.3,;.26,4.32,;.58,2.81,)|
CC1CC1(O)[C@@]1(N(Cc2ccc(cn2)C#N)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC3CCC(O)C3)(c2c(F)c1)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@H]3CC[C@@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](O[C@@H]3CC[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1
COc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(c2ccc(Cl)cc2)C2(O)CC2C)C(C)(C)O)cn1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(cc1)C(F)(F)F
CC(C)(O)CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(CO)CC1)c1ccc(cc1)C(C)(F)F
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)CN(C)C)c1ccc(Cl)cc1
CC(C)(c1cc2c(c(c1)F)[C@@](N(C2=O)Cc3ccc(cn3)C#N)(c4ccc(cc4)Cl)OCC5(CC5)CO)O
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OCC1(C)COC1)c1ccc(Cl)cc1
Cc1ccc(CN2C(=O)c3cc(cc(F)c3[C@]2(OCC2(CO)CC2)c2ccc(Cl)cc2)C(C)(C)O)nc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1cn[nH]c1)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ncc(Cl)cn3)C(OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1
COCC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@@](c2c(F)c1)(c1ccc(Cl)cc1)C1(O)CC1C
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC(C)(CO)CO)(c2c(F)c1)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(F)c(F)c1
CC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(cn1)C#N)[C@@]2(OCC1CC1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1cccnc1)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(C)O)c1ccc(OC(F)(F)F)cc1
CCC(O)CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(C)O)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC3CCCC3CO)(c2c(F)c1)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1
C[C@H](N1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CC1)C(N)=O)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cn1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1
C[C@@H](N1C(=O)c2cc(cc(F)c2[C@]1(OCC1(CC1)C(N)=O)c1ccc(Cl)cc1)C(C)(C)O)c1ccc(Cl)cn1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC3CCCC3O)(c2c(F)c1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1ccncc1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1cncnc1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCNCC1)c1ccc(Cl)cc1
CNC(=O)C1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)C1CCN(CC1)C(C)=O)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CNC1CC1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCOCC1)c1ccc(Cl)cc1
CNCC(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OC)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CNC(C)=O)c1ccc(Cl)cc1
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(N)CC3)(c2c(F)c1)c1ccc(Cl)cc1
CC(O)(C1CCOCC1)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OCC3(CO)CC3)(c2c(F)c1)c1ccc(Cl)cc1
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC3CC(O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |wD:19.20,(-5.21,3.38,;-5.21,1.84,;-6.55,1.07,;-6.55,2.61,;-3.88,1.07,;-2.55,1.84,;-1.21,1.07,;.25,1.55,;.73,3.01,;1.16,.3,;2.7,.3,;3.47,1.64,;5.01,1.64,;5.78,2.97,;5.01,4.3,;3.47,4.3,;2.7,2.97,;5.78,5.64,;6.55,6.97,;.25,-.94,;1.4,-1.97,;2.86,-1.5,;3.56,-.13,;4.93,-.83,;6.4,-.35,;4.23,-2.2,;-1.21,-.47,;-2.55,-1.24,;-2.55,-2.78,;-3.88,-.47,;-.07,-2.45,;1.08,-3.48,;.76,-4.99,;-.71,-5.46,;-1.03,-6.97,;-1.85,-4.43,;-1.53,-2.93,)|
CC(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)[C@](OC[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |wU:24.25,22.22,wD:19.20,(-5.21,3.93,;-5.21,2.39,;-6.55,1.62,;-6.55,3.16,;-3.88,1.62,;-2.55,2.39,;-1.21,1.62,;.25,2.1,;.73,3.56,;1.16,.85,;2.7,.85,;3.47,2.19,;5.01,2.19,;5.78,3.52,;5.01,4.85,;3.47,4.85,;2.7,3.52,;5.78,6.19,;6.55,7.52,;.25,-.39,;-.07,-1.9,;-1.53,-2.38,;-1.85,-3.88,;-3.14,-4.72,;-2.31,-6.01,;-2.63,-7.52,;-1.01,-5.17,;-1.21,.08,;-2.55,-.69,;-2.55,-2.23,;-3.88,.08,;1.4,-1.43,;2.86,-.95,;4.01,-1.98,;3.69,-3.49,;4.83,-4.52,;2.22,-3.96,;1.08,-2.93,)|
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CC1CCOCC1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)COCCO)c1ccc(Cl)cc1
CC(O)(CN1CCNCC1)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1cnn(C)c1)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)c1ccc[n+]([O-])c1)c1ccc(Cl)cc1
COc1cc(ccn1)C(C)(O)c1ccc2c(c1)C(=O)N(Cc1ccc(Cl)cn1)[C@@]2(OC)c1ccc(Cl)cc1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1CCN(CC1)C(C)=O)c1ccc(Cl)cc1
OC1CC(COC2(N(C(=O)c3cccc(F)c23)c2ccc(cn2)C#N)c2ccc(Cl)cc2)C1 |(-6.15,4.88,;-4.82,4.11,;-3.33,4.51,;-2.94,3.02,;-1.6,2.25,;-1.6,.71,;-.27,-.06,;-1.17,-1.3,;-.27,-2.55,;-.74,-4.01,;1.2,-2.07,;2.53,-2.84,;3.86,-2.07,;3.86,-.53,;2.53,.24,;2.53,1.78,;1.2,-.53,;-2.71,-1.3,;-3.48,.03,;-5.02,.03,;-5.79,-1.3,;-5.02,-2.64,;-3.48,-2.64,;-7.33,-1.3,;-8.87,-1.3,;.36,1.35,;-.55,2.6,;.08,4,;1.61,4.16,;2.24,5.57,;2.52,2.92,;1.89,1.51,;-4.42,2.62,)|
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cn4)[C@](OCC4(CC4)C(N)=O)(c3c(F)c2)c2ccc(Cl)cc2)CC1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(ccc12)C(C)(O)CN1C[C@@H]2C[C@H]1CN2C)c1ccc(Cl)cc1
CS(=O)C1(CO[C@]2(N(Cc3ccc(Cl)cn3)C(=O)c3cc(cc(F)c23)C(C)(C)O)c2ccc(Cl)cc2)CC1
COCC(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](OCC3(CC3)C(N)=O)(c2c(F)c1)c1ccc(Cl)cc1
CN1CCN(CC(C)(O)c2cc3C(=O)N(Cc4ccc(Cl)cn4)[C@](OCC4(O)CC4)(c3c(F)c2)c2ccc(Cl)cc2)CC1
CO[C@]1(N(Cc2ccc(Cl)cn2)C(=O)c2cc(cc(F)c12)C(C)(O)C1CCN(CC1)C(C)=O)c1ccc(Cl)cc1
COC[C@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1
COC[C@@](C)(O)c1cc2C(=O)N(Cc3ccc(Cl)cn3)[C@](O[C@H]3CCOC3)(c2c(F)c1)c1ccc(Cl)cc1
CC1CC1(O)[C@@]1(N(Cc2ccc(cn2)C#N)C(=O)c2cc(cc(F)c12)C(C)(O)c1cnn(C)c1)c1ccc(Cl)cc1
Cn1cc(cn1)C(O)Cc1cc2C(=O)N(Cc3cc(Cl)cc[n+]3[O-])C(OCC3(CC3)C#N)(c2c(F)c1)c1ccc(Cl)cc1
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(Cl)c[n+]3[O-])[C@](OCC3(O)CC3)(c2c(F)c1)c1ccc(Cl)cc1
Cn1cc(cn1)C(C)(O)c1cc2C(=O)N(Cc3ccc(cn3)C#N)C(O[C@@H]3C[C@H](O)C3)(c2c(F)c1)c1ccc(Cl)cc1 |wD:26.27,28.30,(-8.53,.71,;-7,.55,;-5.97,1.7,;-4.56,1.07,;-4.72,-.46,;-6.23,-.78,;-3.23,1.84,;-2.46,3.18,;-4,3.18,;-1.9,1.07,;-.56,1.84,;.77,1.07,;2.24,1.55,;2.71,3.01,;3.14,.3,;4.68,.3,;5.45,1.64,;4.68,2.97,;5.45,4.3,;6.99,4.3,;7.76,2.97,;6.99,1.64,;7.76,5.64,;8.53,6.97,;2.24,-.94,;3.38,-1.97,;4.85,-1.5,;5.54,-.13,;6.92,-.83,;8.38,-.35,;6.22,-2.2,;.77,-.47,;-.56,-1.24,;-.56,-2.78,;-1.9,-.47,;1.92,-2.45,;.45,-2.93,;.13,-4.43,;1.28,-5.46,;.96,-6.97,;2.74,-4.99,;3.06,-3.48,)|
CC(C)[C@@H](CS(=O)(=O)C(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(Cl)c1F)C(N)=O |r|
COc1cc(C(N)=O)ccc1NC(=O)[C@]1(C)N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(N)=O)ccc1NC(=O)[C@@]1(C)N[C@H](CC(C)(C)C)[C@]2(CNc3cc(Cl)ccc32)[C@@H]1c1cccc(Cl)c1F
COc1cc(C(N)=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ncc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(N)=O)ccc1NC(=O)[C@H]1N[C@H](CC(C)(C)C)[C@]2(CNc3cc(Cl)ncc32)[C@@H]1c1cccc(Cl)c1F
COc1cc(C(N)=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(C(F)(F)F)ncc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(N)=O)ccc1NC(=O)[C@H]1N[C@H](CC(C)(C)C)[C@]2(CNc3cc(C(F)(F)F)ncc32)[C@@H]1c1cccc(Cl)c1F
CC(C)(C)C[C@@H]1N[C@@H](C(=O)N2CCOc3cc(C(N)=O)ccc32)[C@H](c2cccc(Cl)c2F)[C@]12CNc1cc(Cl)ccc12
CC(C)(C)C[C@H]1N[C@H](C(=O)N2CCOc3cc(C(N)=O)ccc32)[C@@H](c2cccc(Cl)c2F)[C@@]12CNc1cc(Cl)ccc12
COc1cc(C(=O)NCCCC#Cc2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)NCCCC#Cc2cccc3c2CN([C@@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)NCCCC#Cc2cccc3c2CN([C@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)NCCCC#Cc2cccc3c2CN(C2CCC(=O)N(C)C2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC(C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)NC23CC(C#Cc4cccc5c4CN(C4CCC(=O)NC4=O)C5=O)(C2)C3)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC3(CC2)CC([C@@H]2C[C@H]2C#Cc2cccc4c2CN(C2CCC(=O)NC2=O)C4=O)C3)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC3(CC2)CC([C@H]2C[C@@H]2C#Cc2cccc4c2CN(C2CCC(=O)NC2=O)C4=O)C3)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC[C@H](CC#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC[C@@H](CC#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC([C@@H]3C[C@H]3C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC([C@H]3C[C@@H]3C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC[C@H](C#Cc3cccc4c3CN([C@H]3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC[C@H](C#Cc3cccc4c3CN([C@@H]3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC[C@@H](C#Cc3cccc4c3CN([C@H]3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(N2CCC[C@@H](C#Cc3cccc4c3CN([C@@H]3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N[C@H]2CCC[C@@H](C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N[C@@H]2CCC[C@H](C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N[C@@H]2CCC[C@@H](C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N[C@H]2CCC[C@H](C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCCC[C@@H]2CCC#Cc2cccc3c2CN([C@@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCCC[C@@H]2CCC#Cc2cccc3c2CN([C@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCCC[C@H]2CCC#Cc2cccc3c2CN([C@@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCCC[C@H]2CCC#Cc2cccc3c2CN([C@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC3(CC2)CC(C#Cc2cccc4c2CN(C2CCC(=O)NC2=O)C4=O)C3)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC3(CC2)C[C@H]3C#Cc2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC3(CC2)C[C@@H]3C#Cc2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CC[C@H](C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CC[C@@H](C#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N[C@@H]2CCCN(CC#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCN(CC#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)CC2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N[C@H]2CCCN(CC#Cc3cccc4c3CN(C3CCC(=O)NC3=O)C4=O)C2)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC3(CC2)C[C@@H]3C#Cc2cccc3c2CN([C@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(C(F)(F)F)ncc32)[C@H]1c1cccc(Cl)c1F
COc1cc(C(=O)N2CCC3(CC2)C[C@@H]3C#Cc2cccc3c2CN([C@H]2CCC(=O)NC2=O)C3=O)ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(O)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC2CCC2)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(O)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O |r,t:39|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=O |r|
CC(C)C[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(O)=O |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@](C)(CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O |r,c:59|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC1=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O |r,c:63|
c1ccc(cc1)c2c(n(cn2)Cc3ccc(cc3)Cl)c4c5ccc(cc5[nH]c4C(=O)O)Cl
CC(C)Oc1cc(ccc1C2=N[C@H]([C@H](N2C(=O)N3CCNC(=O)C3)c4ccc(cc4)Cl)c5ccc(cc5)Cl)OC
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC1=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O |r,c:63|
Clc1ccc(CN(CC(=O)NC2CCCCC2)C(=O)c2cc3ccccc3[nH]2)cc1
CC(C)N(CC(N)=O)C(=O)c1cc2c(nc(NCCc3c[nH]c4ccccc34)nc2n1CCCc1ccc(Cl)cc1Cl)N(C)C
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](C)NC1=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(N)=O |r,t:39|
CN(C)CCCN(C)[C@H]1CCN(C1)C(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccccc1 |r,wD:8.7,(-5.37,10.95,;-4.13,10.05,;-2.72,10.67,;-4.29,8.51,;-3.04,7.61,;-3.2,6.08,;-1.96,5.17,;-.55,5.8,;-2.12,3.64,;-3.45,2.87,;-3.13,1.36,;-1.6,1.2,;-.97,2.61,;-.83,-.13,;-1.6,-1.46,;.71,-.13,;1.61,1.12,;3.08,.64,;4.41,1.41,;5.75,.64,;7.08,1.41,;5.75,-.9,;4.41,-1.67,;3.08,-.9,;1.61,-1.38,;1.14,-2.84,;2.04,-4.09,;1.14,-5.33,;-.33,-4.86,;-.33,-3.32,;-1.57,-2.41,;-2.98,-3.04,;-3.14,-4.57,;-4.55,-5.2,;-5.79,-4.29,;-7.2,-4.92,;-5.63,-2.76,;-4.23,-2.13,;3.58,-4.09,;4.35,-2.75,;5.89,-2.75,;6.66,-4.09,;5.89,-5.42,;4.35,-5.42,)|
Cc1c(ccc2c1[nH]cc2/C=C\3/C(=O)N(C(=O)N3)Cc4ccc(c(c4)F)F)Cl
Cc1c(Cl)ccc2c(\C=C3/NC(=O)N(C(C(=O)NC(CO)CO)c4ccc(F)c(F)c4)C3=O)c[nH]c12
COOc1cc(\C=C2\C(C)=NN(C2=O)c2ccccc2)cc(Cl)c1OCC(=O)OC |c:9|
Cc1ccc(cc1)N2CC[C@@H](C2)NC(=O)c3c[nH]c4c3cccc4OC
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
CCOc1cc(ccc1C1=N[C@@H]([C@@H](N1C(=O)N1CCN(CC(=O)NCCOCCOCCOCCNC(=O)CN2CCN(CC2=O)C(=O)N2[C@@H]([C@@H](N=C2c2ccc(cc2OCC)C(C)(C)C)c2ccc(Cl)cc2)c2ccc(Cl)cc2)C(=O)C1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |r,c:54,t:10|
OC(=O)[C@H]1[C@@H](N(Cc2ccc(Cl)cc2)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r|
COc1ccccc1N1CCN(CC1)C(=O)[C@@]1(CCCN(C1)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(CCCN(C1)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(C[C@@H](C)CN(C1)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(C[C@H](C)CN(C1)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@]1(CN(CC(C)(C)C1)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
COc1ccccc1N1CCN(CC1)C(=O)[C@@]1(C[C@@H](CN(C1)C(=O)c1cnccc1C(F)(F)F)c1ccccc1)Oc1ccc(cc1)C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@]1(CN(CC[C@H]1c1ccc(F)cc1)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(CC[C@@H](N(C1)C(=O)c1cnccc1C(F)(F)F)c1ccccc1)Oc1ccc(cc1)C(F)(F)F |r|
[H][C@@]12C[C@]1([H])N(C[C@](C2)(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCN(CC1)c1ccccc1OC)C(=O)c1cnccc1C(F)(F)F |r|
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(CCCN([C@@H]1CC=C)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C1=O)(C)CC(=O)O)c2cccc(c2)Cl)c3ccc(cc3)Cl
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N2[C@@H]([C@H](O[C@@H](C2=O)CC(=O)O)c3cccc(c3)Cl)c4ccc(cc4)Cl
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](O[C@@H](C1=O)CC(=O)O)c2cccc(c2)Cl)c3ccc(cc3)Cl
CC[C@@H](CN(C)S(=O)(=O)C1CC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(c1ccccc1)S(=O)(=O)C1CC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(c1ccccc1F)S(=O)(=O)C1CC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(c1ccc(F)cc1)S(=O)(=O)C1CC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(c1ccc(F)cc1F)S(=O)(=O)C1CC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(c1ccccc1F)S(=O)(=O)C(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(c1ccccc1F)S(C)(=O)=O)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)CC)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)CC(C)(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C1CCCC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)c1ccccc1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)N(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C1COC1)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](CC(F)(F)F)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](O[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](O[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@]1(C[C@@H]([C@H](N(C1=O)[C@H](CS(=O)(=O)C(C)(C)C)C2CC2)c3ccc(cc3)Cl)c4cccc(c4)Cl)Cc5ccc(cn5)C(=O)O
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2cc(ccn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2nc(CC(O)=O)cs2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@]1(C[C@@H]([C@H](N(C1=O)[C@H](CS(=O)(=O)C(C)(C)C)C2CC2)c3ccc(c(c3)F)Cl)c4cccc(c4)Cl)Cc5ncc(s5)CC(=O)O
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(Cc2noc(=O)[nH]2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(=O)NS(=O)(=O)C(F)(F)F)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(=O)CO)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(N)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(N)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CS(N)(=O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N2CC[C@H](C2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N2CC[C@@H](C2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ccccn2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ccccc2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2cccc(n2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ccc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ccc(CC(O)=O)cn2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ccc(cn2)C(C)(C)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
Cc1nc(C[C@@]2(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C3CC3)C2=O)c2ccc(Cl)cc2)c2cccc(Cl)c2)ccc1C(O)=O |r|
Cc1cc(C[C@@]2(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C3CC3)C2=O)c2ccc(Cl)cc2)c2cccc(Cl)c2)ncc1C(O)=O |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2cnc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ccc(cc2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cn2cc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2nc(cs2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C(=O)CO)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2nccs2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(CC(O)=O)s2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C(C)(C)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C2(CC2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C(F)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(s2)C(F)(F)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(CC(O)=O)o2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2nnc(CC(O)=O)[nH]2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(Cc2ncc(CC(O)=O)[nH]2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@]1(C(=O)N([C@@H]([C@H](O1)c2cccc(c2)Cl)c3ccc(cc3)Cl)[C@H](CS(=O)(=O)C(C)(C)C)C4CC4)Cc5ccc(cn5)C(=O)O
C[C@@]1(C(=O)N([C@@H]([C@H](O1)c2cccc(c2)Cl)c3ccc(cc3)Cl)[C@H](CS(=O)(=O)C(C)(C)C)C4CC4)Cc5ccc(cn5)C(=O)O
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@@](C)(Cc2ccc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(Cc2nnn[nH]2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](O[C@H](C1=O)CC(=O)O)c2cccc(c2)Cl)c3ccc(cc3)Cl
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=O |r|
Nc1nnc(o1)-c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1c(CC(=O)NC2CCCCC2)ccc(Cl)c1F |(63.6,-25.42,;63.55,-26.96,;62.27,-27.82,;62.7,-29.3,;64.24,-29.35,;64.76,-27.9,;65.1,-30.63,;66.65,-30.68,;67.07,-32.16,;68.51,-32.69,;68.78,-34.21,;70.22,-34.74,;71.4,-33.75,;71.13,-32.23,;69.69,-31.7,;65.79,-33.02,;64.58,-32.07,;63.04,-32.07,;62.27,-33.39,;60.74,-33.39,;59.96,-32.05,;58.42,-32.04,;60.74,-30.72,;59.98,-29.38,;62.28,-30.73,;65.74,-34.55,;64.37,-35.27,;63.07,-34.45,;61.71,-35.17,;60.4,-34.36,;61.65,-36.71,;60.29,-37.43,;58.99,-36.61,;57.63,-37.32,;57.57,-38.86,;58.87,-39.69,;60.24,-38.97,;64.32,-36.81,;65.62,-37.63,;66.99,-36.9,;68.3,-37.72,;67.04,-35.37,;68.4,-34.64,)|
CC(C)(C)NC(=O)Cc1ccc(Cl)c(F)c1-n1c(nc(-c2nnc(N)o2)c1-c1ccc(F)c(Cl)c1)C1CCCCC1 |(2.75,-50.65,;4.05,-51.47,;4,-53.01,;2.71,-52.23,;5.42,-50.75,;5.47,-49.21,;4.17,-48.39,;6.83,-48.49,;8.14,-49.31,;8.08,-50.85,;9.39,-51.67,;10.75,-50.94,;12.06,-51.75,;10.8,-49.41,;12.16,-48.68,;9.5,-48.59,;9.56,-47.06,;10.83,-46.2,;10.41,-44.72,;8.87,-44.67,;8,-43.39,;6.46,-43.34,;6.04,-41.86,;7.31,-41,;7.36,-39.46,;8.53,-41.94,;8.35,-46.11,;6.81,-46.11,;6.04,-47.43,;4.5,-47.43,;3.73,-46.09,;2.19,-46.08,;4.51,-44.76,;3.75,-43.42,;6.05,-44.77,;12.28,-46.73,;12.54,-48.25,;13.99,-48.78,;15.17,-47.79,;14.9,-46.27,;13.45,-45.74,)|
OC(=O)c1nc(-c2ccccc2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F |(7.47,-12.21,;6.8,-13.6,;5.26,-13.71,;7.66,-14.88,;9.2,-14.93,;9.63,-16.41,;11.07,-16.94,;11.33,-18.46,;12.78,-18.99,;13.96,-18,;13.69,-16.48,;12.25,-15.95,;8.35,-17.27,;7.14,-16.32,;5.6,-16.32,;4.83,-17.64,;3.29,-17.64,;2.52,-16.3,;.98,-16.29,;3.3,-14.97,;2.53,-13.63,;4.84,-14.98,;8.29,-18.81,;6.93,-19.53,;6.87,-21.06,;8.18,-21.88,;9.54,-21.16,;10.85,-21.97,;9.59,-19.62,;10.95,-18.89,)|
Fc1ccc(cc1Cl)-c1c(nc(C2CCCCC2)n1-c1cccc(Cl)c1F)-c1nnn[nH]1 |(48.97,-18.08,;50.51,-18.09,;51.28,-19.43,;52.82,-19.43,;53.59,-18.11,;52.83,-16.77,;51.29,-16.76,;50.53,-15.42,;55.13,-18.11,;55.65,-16.67,;57.19,-16.72,;57.61,-18.2,;59.06,-18.73,;59.32,-20.25,;60.77,-20.78,;61.95,-19.79,;61.68,-18.27,;60.23,-17.74,;56.34,-19.06,;56.28,-20.59,;54.92,-21.31,;54.86,-22.85,;56.17,-23.67,;57.53,-22.94,;58.84,-23.76,;57.58,-21.41,;58.94,-20.68,;54.78,-15.39,;53.24,-15.34,;52.82,-13.86,;54.09,-13,;55.31,-13.94,)|
OC(=O)c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F |(23.17,-13.47,;22.5,-14.86,;20.96,-14.97,;23.36,-16.14,;24.91,-16.19,;25.33,-17.67,;26.77,-18.2,;27.04,-19.72,;28.48,-20.25,;29.67,-19.26,;29.39,-17.74,;27.95,-17.21,;24.05,-18.53,;22.84,-17.58,;21.3,-17.58,;20.53,-18.9,;18.99,-18.9,;18.22,-17.56,;16.68,-17.55,;19,-16.23,;18.24,-14.89,;20.54,-16.24,;24,-20.07,;22.63,-20.79,;22.58,-22.32,;23.88,-23.14,;25.25,-22.41,;26.56,-23.23,;25.3,-20.88,;26.66,-20.15,)|
CNC(=O)Cc1ccc(Cl)c(F)c1-n1c(nc(-c2nnc(N)o2)c1-c1ccc(F)c(Cl)c1)C1CCCCC1 |(31.38,-37.05,;32.74,-36.33,;32.8,-34.79,;31.49,-33.97,;34.16,-34.07,;35.46,-34.89,;35.41,-36.43,;36.71,-37.25,;38.08,-36.52,;39.38,-37.33,;38.13,-34.99,;39.49,-34.26,;36.83,-34.17,;36.88,-32.64,;38.16,-31.78,;37.74,-30.3,;36.19,-30.25,;35.32,-28.97,;33.79,-28.92,;33.36,-27.44,;34.64,-26.58,;34.69,-25.04,;35.85,-27.52,;35.67,-31.69,;34.13,-31.69,;33.36,-33.01,;31.83,-33.01,;31.05,-31.67,;29.51,-31.66,;31.83,-30.34,;31.07,-29,;33.37,-30.35,;39.6,-32.31,;39.87,-33.83,;41.31,-34.36,;42.49,-33.37,;42.22,-31.85,;40.78,-31.32,)|
Nc1nnc(o1)-c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F |(19.48,-25.13,;19.43,-26.67,;18.15,-27.53,;18.58,-29.01,;20.12,-29.06,;20.64,-27.62,;20.99,-30.34,;22.53,-30.39,;22.95,-31.88,;24.4,-32.4,;24.66,-33.92,;26.1,-34.45,;27.29,-33.46,;27.02,-31.94,;25.57,-31.42,;21.67,-32.74,;20.46,-31.79,;18.93,-31.78,;18.16,-33.11,;16.62,-33.1,;15.85,-31.76,;14.31,-31.75,;16.63,-30.43,;15.86,-29.09,;18.17,-30.44,;21.62,-34.27,;20.26,-34.99,;20.2,-36.52,;21.51,-37.34,;22.87,-36.62,;24.18,-37.43,;22.92,-35.08,;24.28,-34.35,)|
Nc1nnc(o1)-c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1c(CC(=O)Nc2ccccc2)ccc(Cl)c1F |(48.79,-24.38,;48.74,-25.92,;47.46,-26.78,;47.89,-28.26,;49.43,-28.31,;49.96,-26.86,;50.3,-29.59,;51.84,-29.64,;52.26,-31.12,;53.71,-31.65,;53.97,-33.17,;55.42,-33.7,;56.6,-32.71,;56.33,-31.19,;54.88,-30.66,;50.99,-31.98,;49.77,-31.03,;48.24,-31.03,;47.47,-32.35,;45.93,-32.35,;45.16,-31.01,;43.62,-31,;45.94,-29.68,;45.17,-28.34,;47.48,-29.69,;50.93,-33.51,;49.57,-34.23,;48.26,-33.42,;46.9,-34.13,;45.6,-33.32,;46.84,-35.67,;45.48,-36.39,;44.18,-35.57,;42.82,-36.29,;42.77,-37.83,;44.08,-38.65,;45.43,-37.93,;49.51,-35.77,;50.82,-36.59,;52.18,-35.86,;53.49,-36.68,;52.23,-34.33,;53.59,-33.6,)|
OC(=O)c1nc(-c2ccccc2)n(c1-c1cccc(Cl)c1)-c1cccc(Cl)c1F |(41.13,-1.76,;40.46,-3.15,;38.92,-3.25,;41.32,-4.43,;42.86,-4.48,;43.29,-5.96,;44.73,-6.49,;44.99,-8.01,;46.44,-8.54,;47.62,-7.55,;47.35,-6.03,;45.91,-5.5,;42.01,-6.82,;40.8,-5.87,;39.26,-5.87,;38.49,-7.19,;36.95,-7.19,;36.18,-5.85,;36.96,-4.52,;36.19,-3.18,;38.5,-4.53,;41.95,-8.36,;40.59,-9.08,;40.53,-10.61,;41.84,-11.43,;43.21,-10.7,;44.51,-11.52,;43.26,-9.17,;44.61,-8.44,)|
Cc1cccc(c1)-c1nc(C(O)=O)c(-c2cccc(Cl)c2)n1-c1cc(Cl)ccc1C |(65.23,-4.64,;64.05,-5.63,;64.32,-7.16,;63.14,-8.15,;61.7,-7.62,;61.43,-6.1,;62.61,-5.11,;59.99,-5.57,;59.57,-4.09,;58.02,-4.03,;57.16,-2.75,;57.83,-1.37,;55.62,-2.86,;57.5,-5.48,;55.96,-5.47,;55.19,-6.8,;53.66,-6.8,;52.88,-5.46,;53.66,-4.12,;52.9,-2.79,;55.2,-4.13,;58.71,-6.43,;58.66,-7.96,;59.96,-8.77,;59.91,-10.31,;61.22,-11.12,;58.54,-11.04,;57.24,-10.22,;57.29,-8.68,;55.99,-7.86,)|
Cc1ccc(Cl)cc1-n1c(nc(C(O)=O)c1-c1cccc(Cl)c1)-c1ccccc1 |(21.82,-8.31,;23.13,-9.13,;23.07,-10.66,;24.38,-11.48,;25.74,-10.75,;27.05,-11.57,;25.79,-9.22,;24.49,-8.41,;24.55,-6.87,;25.82,-6.01,;25.4,-4.53,;23.86,-4.48,;22.99,-3.2,;23.67,-1.81,;21.46,-3.31,;23.33,-5.92,;21.8,-5.92,;21.03,-7.24,;19.49,-7.24,;18.72,-5.9,;19.5,-4.57,;18.73,-3.23,;21.04,-4.58,;27.27,-6.54,;27.53,-8.06,;28.98,-8.59,;30.16,-7.6,;29.89,-6.08,;28.44,-5.56,)|
NC(=O)c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F |(38.74,-13.77,;38.07,-15.15,;36.53,-15.26,;38.93,-16.43,;40.48,-16.49,;40.9,-17.97,;42.34,-18.5,;42.61,-20.02,;44.05,-20.55,;45.24,-19.56,;44.96,-18.04,;43.52,-17.51,;39.62,-18.83,;38.41,-17.88,;36.87,-17.88,;36.1,-19.2,;34.56,-19.2,;33.79,-17.86,;32.25,-17.85,;34.57,-16.53,;33.81,-15.19,;36.11,-16.53,;39.57,-20.37,;38.2,-21.09,;38.14,-22.62,;39.45,-23.44,;40.82,-22.71,;42.13,-23.53,;40.87,-21.18,;42.23,-20.45,)|
Cc1nnc(o1)-c1nc(C2CCCCC2)n(c1-c1ccc(F)c(Cl)c1)-c1cccc(Cl)c1F |(5.33,-24.81,;5.28,-26.35,;4.01,-27.21,;4.43,-28.69,;5.97,-28.75,;6.5,-27.3,;6.84,-30.02,;8.38,-30.08,;8.8,-31.56,;10.25,-32.08,;10.51,-33.6,;11.96,-34.13,;13.14,-33.14,;12.87,-31.62,;11.42,-31.1,;7.53,-32.42,;6.32,-31.47,;4.78,-31.46,;4.01,-32.79,;2.47,-32.78,;1.7,-31.44,;.16,-31.44,;2.48,-30.11,;1.72,-28.77,;4.02,-30.12,;7.47,-33.95,;6.11,-34.67,;6.05,-36.21,;7.36,-37.03,;8.72,-36.3,;10.03,-37.11,;8.77,-34.76,;10.13,-34.04,)|
OC(=O)c1nc(-c2ccccc2)n(c1-c1cccc(Cl)c1)-c1cccc(Cl)c1
CC(C)C[C@H](NC(C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(=O)NO)C(=O)NO |r|
CC(C)(C)NC(=O)C(N(Cc1ccccc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(F)c(F)c1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(Cl)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCCOc1ccc(\C=C2\C(=O)Nc3ccccc23)c(OCCC)c1
COc1ccc(\C=C2\C(=O)Nc3ccccc23)c(OC)c1
COc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)c(OC)c1
COc1ccc(\C=C2\C(=O)Nc3cc(F)ccc23)c(OC)c1
CCCOc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)c(OCCC)c1
CC(C)Oc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)c(OC(C)C)c1
CC(C)Oc1ccc(\C=C2\C(=O)Nc3cc(Cl)ccc23)c(OC(C)C)c1
COc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)c(c1)-c1ccc(cc1)C#N
COc1ccc(\C=C2\C(=O)Nc3cc(F)ccc23)c(c1)-c1ccc(cc1)C#N
COc1cccc(\C=C2\C(=O)Nc3cc(Cl)ccc23)c1-c1ccc(cc1)C#N
COc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)c(c1)-c1ccc(Cl)cc1
COc1ccc(\C=C2\C(=O)Nc3ccc(F)cc23)c(c1)-c1ccc(Cl)cc1
COc1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)c(Br)c1
CC(C)OC1=C(C(N(Cc2ccc(cc2OC(C)(C)C)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1 |t:4|
CC(C)OC1=C(C(N(Cc2ccc(cc2OC(C)C)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1 |t:4|
CCOc1cc(ccc1CN1C(C(C(=O)c2ccccc2)=C(OC(C)C)C1=O)c1ccc(Br)cc1)C(F)(F)F |t:22|
COc1cc(ccc1CN1C(C(C(=O)c2ccccc2)=C(OC(C)C)C1=O)c1ccc(Br)cc1)C(F)(F)F |t:21|
CC(C)OC1=C(C(N(Cc2ccc(cc2F)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1 |t:4|
CC(C)OC1=C(C(N(Cc2ccc(cc2)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1 |t:4|
CC(C)OC1=C(C(N(Cc2cccnc2)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1 |t:4|
CC(C)OC1=C(C(N(CCCn2ccnc2)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1 |t:4|
C[C@@H](NC1=C(C(N(Cc2ccc(cc2OC(C)(C)C)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1)c1ccccc1 |r,t:3|
CC(C)Oc1cc(ccc1CN1C(C(C(=O)c2ccccc2)=C(N[C@H](C)c2ccccc2)C1=O)c1ccc(Br)cc1)C(F)(F)F |r,t:23|
CCOc1cc(ccc1CN1C(C(C(=O)c2ccccc2)=C(N[C@H](C)c2ccccc2)C1=O)c1ccc(Br)cc1)C(F)(F)F |r,t:22|
COc1cc(ccc1CN1C(C(C(=O)c2ccccc2)=C(N[C@H](C)c2ccccc2)C1=O)c1ccc(Br)cc1)C(F)(F)F |r,t:21|
C[C@@H](NC1=C(C(N(Cc2ccc(cc2F)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1)c1ccccc1 |r,t:3|
C[C@@H](NC1=C(C(N(Cc2ccc(cc2)C(F)(F)F)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1)c1ccccc1 |r,t:3|
C[C@@H](NC1=C(C(N(Cc2cccnc2)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1)c1ccccc1 |r,t:3|
C[C@@H](NC1=C(C(N(CCCn2ccnc2)C1=O)c1ccc(Br)cc1)C(=O)c1ccccc1)c1ccccc1 |r,t:3|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCN(CC1)c1ccccc1OCCOC)C(=O)c1cnccc1C(F)(F)F
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(CCCN([C@@H]1CC(O)CO)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F
COCCOc1ccccc1N1CCN(CC1)C(=O)[C@@]1(CCCN([C@@H]1CCO)C(=O)c1cnccc1C(F)(F)F)Oc1ccc(cc1)C(F)(F)F
Cc1[nH]c(c(c1-c1ccn[nH]1)-c1ccccc1)-c1ccccc1
Cc1[nH]c(c(c1-c1ccnc2nnnn12)-c1ccccc1)-c1ccccc1 |(19.28,-24.27,;17.81,-23.8,;16.55,-24.7,;15.32,-23.8,;15.79,-22.34,;17.33,-22.34,;18.29,-21.14,;17.72,-19.71,;18.69,-18.5,;20.21,-18.74,;20.77,-20.18,;22.21,-20.72,;22.14,-22.25,;20.66,-22.65,;19.81,-21.37,;14.83,-21.14,;15.4,-19.71,;14.43,-18.5,;12.91,-18.74,;12.35,-20.17,;13.31,-21.37,;13.83,-24.21,;12.73,-23.12,;11.26,-23.53,;10.87,-25.02,;11.95,-26.11,;13.44,-25.7,)|
Cc1[nH]c(c(c1-c1ccnc2nc3ccccc3n12)-c1ccccc1)-c1ccccc1 |(23.91,-24.16,;22.42,-23.76,;21.24,-24.74,;19.94,-23.91,;20.33,-22.42,;21.86,-22.33,;22.7,-21.04,;21.99,-19.67,;22.82,-18.37,;24.36,-18.44,;25.07,-19.81,;26.56,-20.2,;26.64,-21.74,;27.85,-22.7,;27.62,-24.22,;26.18,-24.78,;24.98,-23.82,;25.21,-22.3,;24.24,-21.11,;19.35,-21.23,;19.89,-19.78,;18.92,-18.6,;17.4,-18.85,;16.85,-20.28,;17.83,-21.47,;18.5,-24.47,;17.3,-23.51,;15.86,-24.07,;15.63,-25.59,;16.84,-26.55,;18.27,-25.99,)|
Cc1[nH]c(c(c1-c1ccnc2[nH]c(=S)[nH]c(=O)c12)-c1ccccc1)-c1ccccc1 |(21.9,-22.75,;20.41,-22.34,;19.21,-23.29,;17.93,-22.44,;18.34,-20.96,;19.87,-20.89,;20.72,-19.61,;19.79,-18.37,;20.44,-16.96,;21.96,-16.79,;22.88,-18.03,;24.4,-17.85,;25.32,-19.09,;26.84,-18.92,;24.69,-20.5,;23.17,-20.67,;22.8,-22.17,;22.24,-19.43,;17.38,-19.76,;17.95,-18.32,;16.99,-17.11,;15.46,-17.35,;14.9,-18.78,;15.85,-19.98,;16.48,-22.98,;15.29,-22,;13.85,-22.54,;13.6,-24.06,;14.78,-25.04,;16.22,-24.5,)|
CC(=O)c1ccc(nc1C)-c1c(C)[nH]c(c1-c1ccccc1)-c1ccccc1
CCOC(=O)c1ccc(nc1C)-c1c(C)[nH]c(c1-c1ccccc1)-c1ccccc1
CCOC(=O)c1ccc(nc1-c1ccccc1)-c1c(C)[nH]c(c1-c1ccccc1)-c1ccccc1
Cc1[nH]c(c(c1-c1ccc(C#N)c(=O)[nH]1)-c1ccccc1)-c1ccccc1
CCOC(=O)c1ccc([nH]c1=O)-c1c(C)[nH]c(c1-c1ccccc1)-c1ccccc1
COc1ccc(-c2nc(c(-c3ccc(Cl)cc3)n2C(=O)N2CCN(CCO)CC2)-c2ccc(Cl)cc2)c(OC(C)C)c1
Cc1[nH]c(c(c1-c1ccnc2ncnn12)-c1ccccc1)-c1ccccc1 |(17.31,-23.85,;15.91,-23.21,;14.57,-23.98,;13.43,-22.95,;14.06,-21.54,;15.59,-21.7,;16.62,-20.57,;16.15,-19.1,;17.19,-17.96,;18.7,-18.28,;19.17,-19.75,;20.57,-20.37,;20.41,-21.91,;18.9,-22.23,;18.13,-20.89,;13.29,-20.2,;14.07,-18.87,;13.3,-17.54,;11.76,-17.54,;10.99,-18.86,;11.75,-20.2,;11.92,-23.26,;10.89,-22.12,;9.39,-22.43,;8.91,-23.9,;9.94,-25.04,;11.44,-24.72,)|
Cc1[nH]c(c(c1-c1ccnc2c(cnn12)C#N)-c1ccccc1)-c1ccccc1 |(17.11,-21.51,;15.65,-21.02,;14.4,-21.91,;13.16,-20.99,;13.65,-19.53,;15.19,-19.55,;16.1,-18.31,;15.49,-16.9,;16.41,-15.66,;17.94,-15.83,;18.55,-17.25,;20.01,-17.73,;20,-19.27,;18.53,-19.74,;17.63,-18.49,;21.27,-16.84,;22.52,-15.94,;12.75,-18.28,;13.4,-16.88,;12.5,-15.63,;10.97,-15.78,;10.33,-17.17,;11.22,-18.43,;11.69,-21.46,;10.56,-20.42,;9.09,-20.88,;8.75,-22.39,;9.89,-23.42,;11.36,-22.96,)|
Cc1[nH]c(c(c1-c1ccon1)-c1ccccc1)-c1ccccc1
Cc1[nH]c(c(c1-c1ccnn1-c1ccccc1)-c1ccccc1)-c1ccccc1 |(19.77,-21.87,;18.32,-21.38,;17.07,-22.28,;15.82,-21.37,;16.3,-19.91,;17.84,-19.91,;18.75,-18.68,;18.29,-17.21,;19.54,-16.3,;20.77,-17.22,;20.29,-18.68,;21.2,-19.92,;20.56,-21.33,;21.47,-22.58,;23,-22.43,;23.63,-21.02,;22.73,-19.77,;15.4,-18.66,;16.03,-17.25,;15.14,-16.01,;13.61,-16.16,;12.97,-17.56,;13.87,-18.81,;14.35,-21.84,;13.21,-20.81,;11.75,-21.28,;11.42,-22.78,;12.56,-23.81,;14.03,-23.34,)|
N[C@H]([C@@H](C1C(=O)Nc2cc(Cl)ccc12)c1cccc(Cl)c1F)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:2.15,25.27,wD:1.24,28.31,(14.74,-11.59,;13.71,-10.44,;12.2,-10.76,;11.73,-12.23,;12.64,-13.48,;14.18,-13.48,;11.73,-14.74,;10.25,-14.26,;8.92,-15.03,;7.59,-14.26,;6.25,-15.03,;7.59,-12.72,;8.92,-11.95,;10.25,-12.71,;11.17,-9.62,;11.66,-8.16,;10.63,-7.01,;9.12,-7.33,;8.65,-8.81,;7.14,-9.13,;9.68,-9.94,;9.21,-11.41,;14.18,-8.98,;13.15,-7.84,;15.69,-8.66,;16.17,-7.19,;15.13,-6.06,;15.62,-4.59,;17.13,-4.27,;17.61,-2.81,;18.15,-5.42,;17.67,-6.88,)|
CC1(C)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:14.16,5.5,28.31,wD:4.28,31.35,(10.71,-33.09,;9.38,-33.87,;10.72,-34.63,;9.23,-32.35,;7.72,-32.03,;6.96,-33.36,;5.86,-32.26,;6.26,-30.76,;5.17,-29.67,;3.66,-30.07,;3.27,-31.58,;1.78,-31.98,;4.37,-32.67,;3.97,-34.16,;7.99,-34.5,;8.9,-35.76,;10.44,-35.75,;8,-37.02,;6.52,-36.55,;5.18,-37.32,;3.85,-36.55,;2.52,-37.32,;3.85,-35.01,;5.18,-34.24,;6.51,-35,;8.12,-30.53,;7.03,-29.45,;9.6,-30.13,;9.99,-28.64,;8.9,-27.56,;9.3,-26.07,;10.78,-25.67,;11.18,-24.18,;11.87,-26.76,;11.48,-28.24,)|
CCC1(CC)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:16.18,7.7,30.33,wD:6.30,33.37,(24,-36.43,;23.99,-34.9,;22.65,-34.13,;23.98,-33.36,;23.97,-31.82,;22.5,-32.61,;20.99,-32.29,;20.22,-33.62,;19.12,-32.52,;19.53,-31.02,;18.43,-29.92,;16.93,-30.33,;16.53,-31.84,;15.04,-32.24,;17.63,-32.93,;17.24,-34.42,;21.25,-34.76,;22.17,-36.02,;23.71,-36.02,;21.26,-37.28,;19.79,-36.81,;18.45,-37.58,;17.11,-36.81,;15.78,-37.58,;17.11,-35.27,;18.44,-34.5,;19.78,-35.26,;21.38,-30.79,;20.29,-29.71,;22.87,-30.38,;23.26,-28.9,;22.16,-27.82,;22.56,-26.33,;24.05,-25.93,;24.45,-24.44,;25.14,-27.02,;24.75,-28.5,)|
CCCC1(CCC)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:18.20,9.9,32.35,wD:8.32,35.39,(39.26,-36.51,;37.93,-35.74,;37.92,-34.2,;36.58,-33.44,;37.91,-32.66,;37.9,-31.12,;39.23,-30.34,;36.43,-31.91,;34.92,-31.59,;34.15,-32.92,;33.05,-31.83,;33.46,-30.32,;32.36,-29.23,;30.86,-29.63,;30.46,-31.14,;28.98,-31.55,;31.56,-32.23,;31.17,-33.72,;35.19,-34.07,;36.1,-35.32,;37.64,-35.32,;35.2,-36.58,;33.72,-36.11,;32.38,-36.88,;31.04,-36.11,;29.71,-36.88,;31.05,-34.57,;32.37,-33.8,;33.71,-34.56,;35.32,-30.09,;34.22,-29.01,;36.8,-29.69,;37.19,-28.2,;36.1,-27.12,;36.5,-25.63,;37.98,-25.23,;38.38,-23.74,;39.07,-26.32,;38.68,-27.8,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:17.20,4.7,wD:16.29,10.10,1.0,(53.34,-24.73,;52.95,-26.21,;51.46,-26.61,;51.06,-28.11,;52.16,-29.18,;53.64,-28.78,;54.04,-27.3,;51.77,-30.67,;50.28,-31.08,;49.19,-29.99,;49.89,-32.57,;51.39,-32.89,;51.55,-34.41,;52.88,-35.18,;53.65,-33.85,;52.32,-33.09,;50.15,-35.05,;49.12,-33.91,;48.02,-32.81,;48.43,-31.31,;47.33,-30.21,;45.82,-30.61,;45.43,-32.12,;43.94,-32.53,;46.53,-33.21,;46.14,-34.7,;51.06,-36.31,;52.6,-36.3,;50.16,-37.57,;48.68,-37.1,;47.34,-37.87,;46.01,-37.1,;44.68,-37.86,;46.01,-35.55,;47.34,-34.78,;48.67,-35.55,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:16.29,17.20,4.7,wD:10.10,1.0,(53.34,-24.73,;52.95,-26.21,;51.46,-26.61,;51.06,-28.11,;52.16,-29.18,;53.64,-28.78,;54.04,-27.3,;51.77,-30.67,;50.28,-31.08,;49.19,-29.99,;49.89,-32.57,;51.39,-32.89,;51.55,-34.41,;52.88,-35.18,;53.65,-33.85,;52.32,-33.09,;50.15,-35.05,;49.12,-33.91,;48.02,-32.81,;48.43,-31.31,;47.33,-30.21,;45.82,-30.61,;45.43,-32.12,;43.94,-32.53,;46.53,-33.21,;46.14,-34.7,;51.06,-36.31,;52.6,-36.3,;50.16,-37.57,;48.68,-37.1,;47.34,-37.87,;46.01,-37.1,;44.68,-37.86,;46.01,-35.55,;47.34,-34.78,;48.67,-35.55,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:17.30,18.21,4.7,wD:10.10,1.0,(66.68,-24.88,;66.28,-26.36,;64.79,-26.77,;64.39,-28.26,;65.49,-29.33,;66.98,-28.94,;67.37,-27.45,;65.1,-30.82,;63.61,-31.23,;62.52,-30.14,;63.22,-32.73,;64.73,-33.04,;64.89,-34.58,;65.98,-35.67,;67.35,-34.97,;67.11,-33.45,;65.59,-33.21,;63.48,-35.2,;62.45,-34.06,;61.35,-32.96,;61.76,-31.46,;60.66,-30.36,;59.16,-30.76,;58.76,-32.28,;57.27,-32.68,;59.86,-33.37,;59.47,-34.86,;64.4,-36.46,;65.94,-36.45,;63.49,-37.72,;62.02,-37.25,;60.67,-38.02,;59.34,-37.25,;58.01,-38.02,;59.34,-35.71,;60.67,-34.94,;62.01,-35.7,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(9.07,-38.56,;8.68,-40.05,;7.19,-40.45,;6.79,-41.95,;7.89,-43.02,;9.37,-42.62,;9.77,-41.14,;7.5,-44.51,;6.01,-44.92,;4.92,-43.83,;5.62,-46.41,;7.12,-46.73,;7.28,-48.26,;8.04,-49.59,;9.56,-49.59,;10.34,-48.27,;9.57,-46.94,;8.04,-46.93,;5.88,-48.89,;4.85,-47.75,;3.75,-46.65,;4.15,-45.15,;3.06,-44.05,;1.55,-44.45,;1.15,-45.96,;-.34,-46.37,;2.26,-47.06,;1.86,-48.54,;6.79,-50.15,;8.33,-50.14,;5.89,-51.41,;4.41,-50.94,;3.07,-51.71,;1.74,-50.94,;.4,-51.71,;1.74,-49.39,;3.07,-48.62,;4.4,-49.39,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:19.32,20.23,4.7,wD:10.10,1.0,(20.39,-39.2,;20,-40.68,;18.51,-41.08,;18.12,-42.56,;19.21,-43.64,;20.69,-43.24,;21.08,-41.76,;18.82,-45.12,;17.34,-45.52,;16.25,-44.44,;16.95,-47.02,;18.45,-47.33,;18.61,-48.85,;19,-47.37,;20.42,-46.74,;21.79,-47.44,;22.08,-48.96,;21.08,-50.14,;19.54,-50.09,;17.21,-49.48,;16.18,-48.34,;15.09,-47.25,;15.49,-45.75,;14.4,-44.66,;12.9,-45.06,;12.5,-46.57,;11.02,-46.97,;13.6,-47.65,;13.21,-49.14,;18.12,-50.73,;19.65,-50.73,;17.22,-51.99,;15.75,-51.52,;14.41,-52.29,;13.08,-51.52,;11.75,-52.29,;13.09,-49.98,;14.41,-49.22,;15.74,-49.98,)|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCC2)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CCC1(CC)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@H](O)CO |r|
OC[C@@H](O)CCNC(=O)[C@@H]1NC2(CCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1NC2(CCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC[C@@H](O)CCNC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CCC1(CC)N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:16.18,7.7,30.33,32.37,wD:6.30,(10.13,-26.77,;10.12,-25.23,;8.78,-24.47,;10.11,-23.69,;10.1,-22.15,;8.62,-22.94,;7.12,-22.62,;6.35,-23.96,;5.25,-22.86,;5.66,-21.36,;4.56,-20.26,;3.06,-20.66,;2.66,-22.17,;1.18,-22.58,;3.76,-23.26,;3.37,-24.75,;7.38,-25.1,;8.3,-26.35,;9.83,-26.35,;7.39,-27.61,;5.92,-27.14,;4.58,-27.91,;3.24,-27.14,;1.91,-27.91,;3.25,-25.6,;4.57,-24.83,;5.91,-25.59,;7.51,-21.12,;6.42,-20.04,;9,-20.72,;9.39,-19.23,;8.61,-17.9,;9.94,-17.13,;11.02,-16.03,;9.15,-15.79,;10.71,-18.45,)|
C[C@@]1(O)C[C@@H](C1)NC(=O)[C@@H]1NC2(CCC2)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:16.19,4.6,1.1,wD:15.28,9.9,(24.14,-15.76,;23.06,-16.86,;22.28,-15.52,;21.73,-17.64,;22.51,-18.96,;23.84,-18.19,;22.12,-20.45,;20.63,-20.86,;19.54,-19.77,;20.24,-22.35,;21.74,-22.67,;21.9,-24.2,;22.99,-25.29,;24.08,-24.2,;22.99,-23.11,;20.5,-24.83,;19.47,-23.69,;18.37,-22.59,;18.78,-21.09,;17.68,-19.99,;16.17,-20.39,;15.78,-21.9,;14.29,-22.31,;16.88,-22.99,;16.48,-24.48,;21.41,-26.09,;22.95,-26.08,;20.51,-27.35,;19.03,-26.88,;17.69,-27.65,;16.36,-26.88,;15.02,-27.65,;16.36,-25.33,;17.69,-24.56,;19.02,-25.33,)|
C[C@@]1(O)C[C@@H](C1)NC(=O)[C@@H]1NC2(CCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:15.28,16.19,4.6,1.1,wD:9.9,(36.42,-16.83,;35.33,-17.93,;34.55,-16.59,;34,-18.7,;34.78,-20.03,;36.11,-19.25,;34.39,-21.51,;32.9,-21.92,;31.81,-20.84,;32.51,-23.42,;34.01,-23.74,;34.17,-25.26,;35.26,-26.35,;36.35,-25.26,;35.26,-24.17,;32.77,-25.89,;31.74,-24.75,;30.64,-23.65,;31.05,-22.15,;29.95,-21.05,;28.45,-21.46,;28.05,-22.97,;26.56,-23.37,;29.15,-24.06,;28.76,-25.55,;33.69,-27.15,;35.23,-27.15,;32.78,-28.41,;31.31,-27.94,;29.96,-28.71,;28.63,-27.94,;27.3,-28.71,;28.63,-26.4,;29.96,-25.63,;31.3,-26.39,)|
C[C@@]1(O)C[C@@H](C1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:17.30,18.21,4.6,1.1,wD:9.9,(50,-16.12,;48.92,-17.21,;48.14,-15.87,;47.59,-17.99,;48.36,-19.31,;49.69,-18.54,;47.97,-20.8,;46.49,-21.21,;45.39,-20.13,;46.09,-22.71,;47.6,-23.03,;47.75,-24.55,;48.52,-25.88,;50.04,-25.89,;50.82,-24.57,;50.05,-23.24,;48.52,-23.23,;46.36,-25.19,;45.32,-24.04,;44.22,-22.94,;44.63,-21.44,;43.53,-20.34,;42.03,-20.75,;41.63,-22.26,;40.14,-22.66,;42.73,-23.35,;42.34,-24.84,;47.27,-26.44,;48.81,-26.44,;46.37,-27.7,;44.89,-27.23,;43.55,-28,;42.21,-27.23,;40.88,-28,;42.21,-25.69,;43.54,-24.92,;44.88,-25.68,)|
OC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
CC(C)NS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)NCC2CCC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)NCC2CC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CCCNS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CCNS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CNS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)NC2CC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)NC2CCC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)NC2CCCC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CC(C)(C)NS(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CCN(CC)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)N2CCCCC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)N2CCOCC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)Nc2ccccc2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)Nc2ccccc2F)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)Nc2ccccn2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CCN(c1ccccc1)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)N2CCc3ccccc23)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CC(C)[C@@H](CS(=O)(=O)N1CCCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CN(C)S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
CCN(C)S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
CN(C1CC1)S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCC(F)(F)C1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@H]1CCCN1S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
C[C@H]1CCCN1S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
CN1CCN(CC1)S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCNCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCS(=O)(=O)CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCC(F)(F)CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCc2ccccc12)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CC(C)(C)c2ccccc12)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)N1CCc2cc(F)ccc12)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)C(=CC1=O)c1ccccc1)c1ccc(Cl)cc1 |c:22|
OC(=O)[C@@H](N1[C@@H](c2ccc(cc2)C(F)(F)F)C(=O)Nc2ccc(I)cc2C1=O)c1ccccc1
C[C@@H](N([C@H](C(N)=O)c1ccc(Cl)cc1)C(=O)\C=C\c1ccccc1)c1ccc(Cl)cc1
OC(=O)C(N(Cc1ccc(cc1)C(F)(F)F)C(=O)c1cccc(I)c1)c1ccccc1
C[C@@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)N(CCCCC(O)=O)C(=CC1=O)c1ccccc1Br)c1ccc(Cl)cc1 |c:22|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1[C@H](C)CC[C@H]1C(=O)N1CCN(C)[C@H](C)C1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1[C@H](C)CC[C@H]1C(=O)N1CCN(C)C2(CC2)C1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1[C@H](C)CC[C@H]1C(=O)N1CCNC2(CC2)C1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)c(F)c1)c1ccc(Cl)cc1)C(=O)N1[C@H](C)CC[C@H]1C(=O)N1CCNC2(CC2)C1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)c(F)c1)c1ccc(Cl)nc1)C(=O)N1[C@H](C)CC[C@H]1C(=O)N1CCNC2(CC2)C1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)c(F)c1)c1ccc(Cl)nc1)C(=O)N1[C@H](C)CC[C@H]1C(=O)N1CC2(CC2)NC[C@@H]1C |r,t:3,6|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)c(F)c1)c1ccc(Cl)nc1)C(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC2(CC2)NC[C@@H]1C |r,t:3,6|
CC[C@@H]1CNC2(CC2)CN1C(=O)[C@@H]1C[C@@H](F)CN1C(=O)C1=C(C(C)C)N2[C@H](c3ccc(Cl)c(F)c3)[C@@](C)(N=C2S1)c1ccc(Cl)nc1 |r,c:23,41|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1F)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N2CC(C2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N[C@H]2C[C@H](C2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r,wU:13.41,16.18,8.8,wD:14.33,22.22,24.27,(.26,-6,;1.33,-5.39,;1.32,-6.62,;2.39,-6.01,;1.33,-3.85,;1.33,-2.62,;.26,-3.23,;2.66,-3.08,;2.67,-1.54,;4,-.77,;5.46,-.81,;4.69,.52,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.39,-.13,;-1.3,-2.29,;-2.59,-3.13,;-3.69,-2.56,;-2.52,-4.66,;-3.81,-5.5,;-5.27,-5.14,;-5.6,-6.65,;-4.09,-6.98,;-6.89,-7.48,;-6.83,-8.71,;-7.98,-6.91,;,-1.54,;,-2.77,;,3.08,;-1.33,3.85,;-1.33,5.39,;0,6.16,;1.34,5.39,;2.41,6,;1.33,3.85,;2.67,1.54,;2.67,3.08,;4.01,3.85,;5.34,3.08,;6.41,3.69,;5.34,1.54,;4,.77,)|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N[C@H]2C[C@@H](C2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r,wU:13.41,16.18,8.8,24.27,wD:14.33,22.22,(.26,-6,;1.33,-5.39,;1.32,-6.62,;2.39,-6.01,;1.33,-3.85,;1.33,-2.62,;.26,-3.23,;2.66,-3.08,;2.67,-1.54,;4,-.77,;5.46,-.81,;4.69,.52,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.39,-.13,;-1.3,-2.29,;-2.59,-3.13,;-3.69,-2.56,;-2.52,-4.66,;-3.81,-5.5,;-5.27,-5.14,;-5.6,-6.65,;-4.09,-6.98,;-6.89,-7.48,;-6.83,-8.71,;-7.98,-6.91,;,-1.54,;,-2.77,;,3.08,;-1.33,3.85,;-1.33,5.39,;0,6.16,;1.34,5.39,;2.41,6,;1.33,3.85,;2.67,1.54,;2.67,3.08,;4.01,3.85,;5.34,3.08,;6.41,3.69,;5.34,1.54,;4,.77,)|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N2CCC(C)(CC2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N2CCC(CC2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)NC23CCC(CC2)(CC3)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N[C@H]2CC[C@H](CC2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r,wU:13.43,16.18,8.8,wD:14.35,22.22,25.29,(.26,-6,;1.33,-5.39,;1.32,-6.62,;2.39,-6.01,;1.33,-3.85,;1.33,-2.62,;.26,-3.23,;2.66,-3.08,;2.67,-1.54,;4,-.77,;5.46,-.81,;4.69,.52,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.39,-.13,;-1.3,-2.29,;-2.59,-3.13,;-3.69,-2.56,;-2.52,-4.66,;-3.81,-5.5,;-5.18,-4.79,;-6.47,-5.63,;-6.4,-7.17,;-5.03,-7.87,;-3.74,-7.04,;-7.7,-8,;-7.64,-9.23,;-8.79,-7.43,;,-1.54,;,-2.77,;,3.08,;-1.33,3.85,;-1.33,5.39,;0,6.16,;1.34,5.39,;2.41,6,;1.33,3.85,;2.67,1.54,;2.67,3.08,;4.01,3.85,;5.34,3.08,;6.41,3.69,;5.34,1.54,;4,.77,)|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)N[C@H]2CC[C@@H](CC2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r,wU:13.43,16.18,8.8,25.29,wD:14.35,22.22,(.26,-6,;1.33,-5.39,;1.32,-6.62,;2.39,-6.01,;1.33,-3.85,;1.33,-2.62,;.26,-3.23,;2.66,-3.08,;2.67,-1.54,;4,-.77,;5.46,-.81,;4.69,.52,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.39,-.13,;-1.3,-2.29,;-2.59,-3.13,;-3.69,-2.56,;-2.52,-4.66,;-3.81,-5.5,;-5.18,-4.79,;-6.47,-5.63,;-6.4,-7.17,;-5.03,-7.87,;-3.74,-7.04,;-7.7,-8,;-7.64,-9.23,;-8.79,-7.43,;,-1.54,;,-2.77,;,3.08,;-1.33,3.85,;-1.33,5.39,;0,6.16,;1.34,5.39,;2.41,6,;1.33,3.85,;2.67,1.54,;2.67,3.08,;4.01,3.85,;5.34,3.08,;6.41,3.69,;5.34,1.54,;4,.77,)|
CN(C(=O)C[C@@]1(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1)c1ccc(cc1)C(O)=O |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2ccc(CC(O)=O)cc2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2ccc(cn2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2ccc(cc2)C#N)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
COc1cc(NC(=O)C[C@@]2(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C3CC3)C2=O)c2ccc(Cl)cc2)c2cccc(Cl)c2)ccc1C(N)=O |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2ccccc2C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2cccc(c2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
COc1cc(ccc1NC(=O)C[C@@]1(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1)C(O)=O |r|
COc1cc(NC(=O)C[C@@]2(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C3CC3)C2=O)c2ccc(Cl)cc2)c2cccc(Cl)c2)ccc1C(O)=O |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2ccc(cc2)C(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(=O)Nc2ccccc2)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
COc1cc(NC(=O)C[C@@]2(C)C[C@@H]([C@H](N([C@H](CS(=O)(=O)C(C)(C)C)C3CC3)C2=O)c2ccc(Cl)cc2)c2cccc(Cl)c2F)ccc1C(O)=O |r|
C[C@@]1(C[C@@H]([C@H](N(C1=O)[C@H](CS(=O)(=O)C(C)(C)C)C2CC2)c3ccc(c(c3)F)Cl)c4cccc(c4)Cl)CC(=O)Nc5ccc(c(c5)OC)C(=O)O
CC(C)(C)C[C@H]1[C@]2(c3ccc(cc3NC2=O)Cl)[C@H]([C@@H](N1)C(=O)NC4CCC(CC4)O)c5cccc(c5F)Cl
CC(C)C[C@H]1N[C@H]([C@H](c2ccccc2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N(C)C |r|
CCOc1cc(OC)ccc1C1=N[C@H]([C@H](N1C(=O)N1CCN(CCO)CC1)c1ccc(Br)cc1)c1ccc(Br)cc1 |r,t:12|
CC(C)C[C@]1(N=CN(CC2CC2)[C@H]1c1ccc(Cl)cc1)C(=O)NCCc1ccncc1 |r,c:5|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(O)=O |r|
CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cn(CCC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(O)=O)nn1 |r|
Cc1ccc(cc1)-c1cn(CCC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(O)=O)nn1 |r|
OC(=O)[C@H](CCCn1cc(nn1)-c1ccc(cc1)C(F)(F)F)NC(=O)OCC1c2ccccc2-c2ccccc12 |r|
OC(=O)[C@H](CCCn1cc(nn1)-c1ccc(Br)cc1)NC(=O)OCC1c2ccccc2-c2ccccc12 |r|
OC(=O)[C@H](CCCn1cc(nn1)-c1ccc(I)cc1)NC(=O)OCC1c2ccccc2-c2ccccc12 |r|
COc1ccc(cc1)-c1cn(CCC[C@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(O)=O)nn1 |r|
COc1cc(CCN(C)C)c2SSSSSc2c1O
NCCc1c2SCOc2c2[nH]ccc3c4ccccc4nc1c23
CSc1c(O)c2nccc3c4ccccc4[nH]c(c1CC=N)c23
COc1c(C)c(CCN(C)C)c2SSSSSc2c1OC
COc1cc(CCN)c2SSSSSc2c1OC
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O |r|
[H][C@@]12CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@]1([H])CSSC[C@]([H])(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@@]([H])(NC(=O)[C@H](CCC(O)=O)NC2=O)[C@@H](C)O)C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CSSC[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(N)=O |r|
FC(F)(F)c1ccc(OC2(CCCN(C2)C(=O)c2cnccc2C(F)(F)F)C(=O)N2CCN(CC2)c2ccccn2)cc1
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(n1)C(O)=O)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(n1)C(=O)OC)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(n1)C(=O)NC)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ncccc1C(N)=O)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cc(ccn1)C(N)=O)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccc(cn1)C(N)=O)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(n1)C(N)=O)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ncccc1CN)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cc(CN)ccn1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccc(CN)cn1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(CN)n1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ncccc1C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cc(ccn1)C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccc(cn1)C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(n1)C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(Br)n1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(Cl)n1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(n1)C(F)(F)F)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(OC)n1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(C)n1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cncnc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccncn1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cnccn1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ncccn1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccncc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccnc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccccn1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccc(cc1)C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(c1)C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccccc1C#N)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccc(Cl)cc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(Cl)c1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccccc1Cl)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1cccc(C)c1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccccc1C)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(Cc2ccc(C)cc2)CC1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Sc1ccc(C)cc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccc(C)cc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(Cc2ccccc2)CC1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Sc1ccccc1)C(=O)c1cnccc1C(F)(F)F |r|
CCC[C@H]1N(CCC[C@@]1(Oc1ccc(cc1)C(F)(F)F)C(=O)N1CCC(CC1)Oc1ccccc1)C(=O)c1cnccc1C(F)(F)F |r|
CCOC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1 |r|
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(C)C)C(=O)OC |r|
CC[C@H](C)[C@H](NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)N[C@@H](C(C)C)C(=O)OC |r|
CC[C@H](C)[C@H](NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)OC |r|
COC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(C)C |r|
COC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(C)C |r|
CNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1 |r|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)NC |r|
Brc1ccc(cc1)[C@H]1Oc2ccccc2C2=Nc3ncnn3[C@H](C12)c1ccc(Br)cc1 |r,t:17|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@H](O)CO |r|
COCCOCCNC(=O)[C@@H]1N[C@H](CC(C)(C)C)[C@@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CN1CCN(CCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@H](O)CO |r|
CN1CCC(CCNC(=O)[C@@H]2N[C@H](CC(C)(C)C)[C@@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NCC[C@@H](O)CO |r|
CC(C)(C)C[C@H]1N[C@H]([C@H](c2cccc(Cl)c2)[C@@]11C(=O)Nc2cc(Cl)c(F)cc12)C(=O)NC[C@H](O)CO |r|
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CCNC(=O)CCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Cc2cc(O)ccc12)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)C(=O)N[C@@H](CCC(O)=O)C(=O)NC1(CC1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(N)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)[C@@H](C)O)C(O)=O |r|
CC[C@H](C)[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2ccccc2)NC1=O)C(C)C |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
COc1ccc(cc1)N1N=C2CC1(C)C(=O)NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c3ccccc13)C(=O)N[C@@H](CCCCNC2=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:10|
COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,12,31,34,36,49,59,84,86,t:2,28,44,46,57,82|
COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,12,31,34,36,49,59,84,86,t:2,28,44,46,57,82|
COc1ccc(cc1)-n1nnc(n1)C(=O)NCCCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
COc1ccc(cc1)-n1nnc(n1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
COc1ccc(cc1)-n1nnc(n1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,wU:74.86,48.62,32.41,20.22,113.124,98.112,wD:84.100,62.75,43.45,24.30,128.134,109.116,122.130,(45.65,16.47,;44.12,16.62,;43.22,15.38,;43.85,13.98,;42.95,12.74,;41.43,12.9,;40.79,14.29,;41.69,15.54,;40.52,11.65,;38.99,11.65,;38.51,10.19,;39.76,9.29,;41,10.19,;39.76,7.76,;41.09,6.97,;38.43,6.97,;38.43,5.43,;37.1,4.66,;37.1,3.13,;35.77,2.36,;35.78,.82,;34.44,.05,;33.11,.81,;33.11,2.36,;31.77,.04,;31.77,-1.5,;33.11,-2.27,;33.11,-3.81,;34.45,-1.5,;30.43,.81,;29.09,.04,;29.09,-1.5,;27.76,.81,;27.76,2.35,;29.09,3.13,;29.09,4.66,;30.42,5.44,;30.41,6.97,;31.74,7.75,;29.08,7.74,;26.43,.03,;25.09,.81,;25.09,2.35,;23.75,.03,;23.75,-1.51,;22.42,.8,;21.08,.03,;21.08,-1.51,;19.75,.8,;19.75,2.35,;21.08,3.11,;22.49,2.49,;23.52,3.64,;22.74,4.97,;23.22,6.44,;22.19,7.59,;20.68,7.27,;20.2,5.8,;21.24,4.65,;18.41,.02,;17.08,.8,;17.08,2.34,;15.74,.02,;15.74,-1.52,;17.08,-2.29,;18.41,-1.52,;19.75,-2.28,;19.75,-3.83,;21.09,-4.59,;18.42,-4.6,;17.08,-3.83,;14.4,.79,;13.07,.02,;13.07,-1.52,;11.74,.79,;11.74,2.33,;13.07,3.1,;14.48,2.48,;15.5,3.63,;14.73,4.97,;13.22,4.64,;10.4,.02,;9.07,.78,;9.07,2.33,;7.73,.01,;7.73,-1.53,;6.4,-2.3,;6.4,-3.83,;5.07,-4.6,;5.07,-6.14,;3.74,-6.91,;2.41,-6.14,;3.75,-8.45,;2.42,-9.22,;5.08,-9.21,;6.39,.78,;5.05,.01,;5.05,-1.53,;3.72,.78,;3.72,2.32,;5.05,3.1,;6.39,2.33,;7.73,3.1,;7.72,4.64,;6.39,5.41,;5.05,4.64,;2.38,0,;1.05,.78,;1.05,2.32,;-.29,.01,;-1.62,.77,;-2.96,.01,;-2.96,-1.54,;-4.3,.77,;-4.3,2.32,;-2.97,3.08,;-2.97,4.63,;-1.63,2.32,;-5.63,0,;-6.96,.77,;-8.29,0,;-6.96,2.31,;-.29,-1.54,;-1.62,-2.31,;1.05,-2.31,;37.11,.05,;37.11,-1.49,;38.45,.82,;39.78,.05,;39.78,-1.49,;41.12,-2.26,;41.12,.83,;42.46,.05,;41.12,2.37,)|
COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC1=CN=CN1)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,12,59,62,64,77,87,112,114,t:2,56,72,74,85,110|
COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,12,55,58,60,73,108,110,t:2,52,68,70,106|
COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,12,59,62,64,77,112,114,t:2,56,72,74,110|
COC1=CC=C(C=C1)N1N=NC(=N1)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CNC2=C1C=CC(Cl)=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(=O)C(C)=C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,12,59,62,65,78,113,115,t:2,56,73,75,111|
COC1=CC=C(C=C1)N1N=C(CC1C(N)=O)C(=O)NCCCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CNC2=C1C=CC=C2)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCNC(C)=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r,c:4,6,10,62,65,67,80,113,115,t:2,59,75,77,111|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCCNC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
OC\C=C/COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OCCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OCCCCOC1(N(Cc2ccc(cc2)C#N)C(=O)c2ccccc12)c1ccc(Cl)cc1
C[C@H](N1C(=O)c2ccccc2C1(OCCCCO)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r|
C[C@@H](N1C(=O)c2ccccc2C1(OCCCCO)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r|
OCCCCOC1(N(CCc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Br)cc1
OCCCCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Br)cc1
OCc1ccc(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)cc1
OC[C@H]1CC[C@H](COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |r,wU:5.5,wD:2.1,(-7.05,-6.08,;-8.14,-7.17,;-7.74,-8.66,;-8.83,-9.76,;-8.42,-11.24,;-6.94,-11.63,;-6.54,-13.11,;-5.05,-13.51,;-4.65,-15,;-3.74,-16.26,;-2.2,-16.26,;-1.43,-17.59,;-2.2,-18.92,;-1.43,-20.25,;.11,-20.25,;.88,-18.91,;.11,-17.58,;.89,-21.59,;.12,-22.93,;2.43,-21.59,;-4.65,-17.51,;-4.17,-18.98,;-6.12,-17.03,;-7.45,-17.8,;-8.79,-17.03,;-8.78,-15.49,;-7.46,-14.72,;-6.12,-15.48,;-3.33,-14.21,;-1.98,-14.96,;-.66,-14.17,;-.69,-12.63,;.63,-11.84,;-2.04,-11.88,;-3.36,-12.68,;-5.85,-10.54,;-6.25,-9.06,)|
OCc1cccc(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)c1
O[C@H]1CCC[C@@H](CCC1)OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r|
OCC#CCOC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC[C@H]1CCCC[C@H]1COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r|
CC(C)(CO)COC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OCC1(COC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
O[C@H]1CC[C@@H](CC1)OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r,wU:4.7,wD:1.0,(-9.71,-36.66,;-8.4,-37.46,;-8.44,-39,;-7.12,-39.8,;-5.79,-39.06,;-5.74,-37.53,;-7.05,-36.73,;-4.48,-39.85,;-4.08,-41.35,;-3.16,-42.6,;-1.62,-42.6,;-.85,-43.93,;-1.62,-45.27,;-.86,-46.6,;.69,-46.6,;1.46,-45.26,;.68,-43.93,;1.47,-47.94,;.7,-49.28,;3.01,-47.94,;-4.08,-43.86,;-3.6,-45.32,;-5.55,-43.38,;-6.88,-44.15,;-8.22,-43.38,;-8.22,-41.83,;-6.89,-41.06,;-5.55,-41.82,;-2.76,-40.55,;-1.41,-41.31,;-.09,-40.52,;-.11,-38.97,;1.21,-38.18,;-1.47,-38.23,;-2.79,-39.02,)|
O[C@H]1CC[C@H](OC2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)C=C1 |r,c:37|
OCC1(COC2(N(Cc3ccc(F)cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(I)cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
Cc1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1
COc1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1
C[C@@H](N1C(=O)c2ccccc2C1(OCC1(CO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r|
OCC1(COC2(N(Cc3cccc4ccccc34)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3cccc(Br)c3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(cc3)C(F)(F)F)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
CSc1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1
COC(=O)c1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1
OCC1(COC2(N(Cc3ccc(cc3)C(O)=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
NC(=O)c1ccc(CN2C(=O)c3ccccc3C2(OCC2(CO)CC2)c2ccc(Cl)cc2)cc1
OCC1(COC2(N(Cc3ccc(cc3)C(=O)c3ccccc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccncc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3cccnc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3cc[n+]([O-])cc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc[n+]([O-])c3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3cccc[n+]3[O-])C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(cc3)-n3cnnc3)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(COC2(N(Cc3ccc(cc3)S(=O)(=O)C(F)(F)F)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1
OCC1(CO[C@]2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |r|
OCC1(CO[C@@]2(N(Cc3ccc(cc3)[N+]([O-])=O)C(=O)c3ccccc23)c2ccc(Cl)cc2)CC1 |r|
CN1c2ncnn2[C@H](C2=C1c1cc(C)ccc1O[C@@H]2c1ccc(Br)cc1)c1ccc(Br)cc1 |r,c:9|
OC1(N(Cc2cccc(Br)c2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2cccc3ccccc23)C(=O)c2ccccc12)c1ccc(Cl)cc1
Nc1ccc(CCN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
OC1(N(CCc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(CCc2ccccc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2cccc(c2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Br)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(F)cc1
OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccccc1
OC1(N(Cc2ccc(cc2)C#N)C(=O)c2ccccc12)c1ccc(Cl)cc1
Cc1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
OC1(N(Cc2ccc(I)cc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(Br)cc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(Cl)cc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc(F)cc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
CCCN1C(=O)c2ccccc2C1(O)c1ccc(Cl)cc1
CSc1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
CS(=O)c1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
CS(=O)(=O)c1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
NS(=O)(=O)c1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
OC1(N(Cc2ccc(cc2)C(F)(F)F)C(=O)c2ccccc12)c1ccc(Cl)cc1
COC(=O)c1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
OC(=O)c1ccc(CN2C(=O)c3ccccc3C2(O)c2ccc(Cl)cc2)cc1
OC1(N(Cc2ccc(cc2)C(=O)c2ccccc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccncc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2cccnc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccccn2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2cc[n+]([O-])cc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2ccc[n+]([O-])c2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1(N(Cc2cccc[n+]2[O-])C(=O)c2ccccc12)c1ccc(Cl)cc1
CCCN1C(=O)c2ccccc2C1(OC1CCC(O)C1)c1ccc(F)cc1
OC1CCC(C1)OC1(N(Cc2ccccc2)C(=O)c2ccccc12)c1ccc(Cl)cc1
OC1CCC(C1)OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1
O[C@@H]1CC[C@@H](C1)OC1(N(Cc2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r|
O[C@@H]1CC[C@@H](C1)OC1(N(Cc2ccc(cc2)C#N)C(=O)c2ccccc12)c1ccc(Cl)cc1 |r|
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1Cc1ccc(OCc2ccccc2F)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCC1)c1nnnn1-c1cccc(OCc2ccccc2)c1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCC1)c1nnnn1-c1cccc(OCc2ccccc2)c1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCCC1)c1nnnn1-c1ccc(OCc2ccccc2)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCC1)c1nnnn1-c1ccc(OCc2ccccc2)cc1
CCCCCNC(c1nnnn1Cc1ccc(Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1Cc1ccc(Cl)cc1
CCCCCNC(c1nnnn1-c1ccc(F)c(Cl)c1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(F)c(Cl)c1
CCCCCNC(c1nnnn1-c1ccc(cc1)C(C)C)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCCCCNC(c1nnnn1-c1ccc(Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(Cl)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCCC1)c1nnnn1-c1cccc(Oc2ccccc2)c1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCC1)c1nnnn1-c1cccc(Oc2ccccc2)c1
CCCCCNC(c1nnnn1Cc1ccc(OCc2ccccc2F)cc1)c1c([nH]c2cc(Cl)ccc12)C(=O)OCC
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCC1)c1nnnn1-c1cccc(OCc2ccccc2)c1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(cc1)C(C)C
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(Cl)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCc1ccc(Cl)cc1)c1nnnn1Cc1ccc(OCc2ccccc2Br)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1Cc1ccc(OCc2ccccc2Br)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1Cc1ccc(OCc2ccccc2Cl)cc1
CCCCCNC(c1nnnn1Cc1ccc(OCc2ccccc2F)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCCCCNC(c1nnnn1-c1ccc(OCc2ccc(Br)cc2)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCCCCNC(c1nnnn1-c1ccc(OCc2c(Cl)cccc2Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(OCc2c(Cl)cccc2Cl)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCC1)c1nnnn1-c1ccc(OCc2ccccc2Br)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(OCc2ccccc2Br)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1C2CC3CC(C2)CC1C3)c1nnnn1-c1ccc(OCc2ccccc2Br)cc1 |TLB:24:23:21:17.18.19,THB:24:18:15.23.22:21,14:15:17.24.18:22.20.21,14:15:21:17.18.19,19:18:15:22.20.21,19:20:15:17.24.18,(61.09,-10.8,;60.32,-9.46,;61.09,-8.13,;58.78,-9.46,;57.87,-10.72,;56.39,-10.24,;55.06,-11.01,;53.73,-10.24,;52.4,-11.01,;53.73,-8.7,;55.06,-7.93,;56.39,-8.69,;57.87,-8.21,;58.34,-6.75,;59.85,-6.43,;60.32,-4.96,;60.84,-3.29,;62.24,-3.15,;63.34,-2.23,;62.69,-.85,;61.17,-.95,;60.18,-1.96,;60.78,-2.51,;61.48,-3.93,;63,-3.82,;57.56,-5.41,;58.18,-3.98,;57.02,-2.95,;55.68,-3.74,;56.02,-5.25,;54.52,-5.64,;53.43,-4.54,;51.93,-4.93,;51.52,-6.42,;50.04,-6.81,;48.95,-5.72,;47.46,-6.11,;47.07,-7.59,;45.59,-7.99,;44.49,-6.89,;44.9,-5.41,;46.39,-5.02,;46.8,-3.53,;52.62,-7.53,;54.12,-7.13,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCC1)c1nnnn1-c1ccc(OCc2ccccc2)cc1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCc1ccc(Cl)cc1)c1nnnn1Cc1ccc(Cl)cc1
CC(C)c1ccc(cc1)-n1nnnc1C(NCC1CCCCC1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCC1)c1nnnn1-c1cccc(Oc2ccccc2)c1
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1Cc1ccc(OCc2ccccc2F)cc1
CCCCCNC(c1nnnn1Cc1ccc(OCc2ccccc2Br)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CCCCCNC(c1nnnn1Cc1ccc(OCc2ccccc2Cl)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NCC1CCCCC1)c1nnnn1-c1ccc(OCc2ccc(Br)cc2)cc1
CCCCCNC(c1nnnn1-c1ccc(OCc2ccccc2Br)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(NC1CCCCCC1)c1nnnn1-c1cccc(OCc2ccccc2)c1
COc1cc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)ccc1C(O)=O |r|
OC(=O)Cc1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
OC(=O)[C@H]1C[C@@H](C1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.31,19.22,5.7,wD:10.10,3.2,(15.44,-35.61,;15.03,-34.13,;16.12,-33.04,;13.55,-33.74,;12.87,-32.36,;11.49,-33.04,;12.17,-34.42,;10.03,-32.55,;8.88,-33.57,;7.45,-33,;9.26,-35.06,;10.7,-35.61,;10.62,-37.14,;11.02,-38.62,;12.5,-39.02,;13.59,-37.94,;13.19,-36.45,;11.7,-36.05,;9.14,-37.55,;8.2,-36.29,;6.86,-34.77,;6.56,-33.25,;5.11,-32.75,;3.95,-33.76,;4.24,-35.28,;3.08,-36.29,;5.7,-35.78,;7.38,-36.76,;10.05,-38.8,;11.46,-39.96,;9.15,-40.06,;7.67,-39.59,;6.33,-40.36,;5,-39.59,;3.66,-40.36,;5,-38.05,;6.33,-37.28,;7.66,-38.04,)|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nc(C)no1 |r|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nc(cs1)C(N)=O |r|
CC1(C)CCC2(CC1)N[C@H]([C@H](c1cccc(Cl)c1F)[C@]21C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:19.22,10.11,33.37,wD:9.34,36.41,(71.57,-7.52,;70.08,-7.92,;71.18,-9.01,;68.99,-9.01,;67.52,-8.61,;67.12,-7.13,;68.2,-6.04,;69.69,-6.44,;67.2,-5.6,;65.76,-5.05,;64.7,-6.28,;63.36,-4.76,;63.06,-3.24,;61.61,-2.75,;60.45,-3.75,;60.74,-5.27,;59.58,-6.28,;62.2,-5.77,;63.88,-6.76,;65.64,-7.54,;66.55,-8.79,;67.96,-9.95,;65.65,-10.05,;64.17,-9.58,;62.83,-10.35,;61.5,-9.58,;60.16,-10.35,;61.5,-8.04,;62.83,-7.27,;64.16,-8.03,;65.35,-3.57,;63.87,-3.17,;66.44,-2.47,;67.93,-2.87,;69,-1.77,;70.49,-2.17,;70.89,-3.66,;72.38,-4.05,;69.8,-4.74,;68.32,-4.35,)|
CS(=O)(=O)NC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
CS(=O)(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
OC(=O)C12CCC(CC1)(CC2)NC(=O)[C@@H]1NC2(CCC(F)(F)CC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
COc1cc(ccc1NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nc(C(O)=O)c(C)o1 |r|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nnc(C)s1 |r|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ncc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(70.81,-33.25,;69.32,-32.86,;68.92,-31.37,;67.43,-30.97,;66.35,-32.07,;66.75,-33.55,;68.23,-33.94,;64.87,-31.67,;63.78,-32.77,;62.29,-32.37,;64.19,-34.25,;65.63,-34.8,;65.55,-36.33,;65.95,-37.81,;67.42,-38.21,;68.51,-37.13,;68.12,-35.64,;66.63,-35.24,;64.07,-36.74,;63.13,-35.48,;61.79,-33.96,;61.49,-32.44,;60.04,-31.94,;58.88,-32.95,;59.17,-34.47,;58.01,-35.48,;60.63,-34.97,;62.31,-35.95,;64.98,-37.99,;66.39,-39.15,;64.08,-39.25,;62.6,-38.78,;61.26,-39.55,;59.93,-38.78,;58.59,-39.55,;59.93,-37.24,;61.26,-36.47,;62.59,-37.23,)|
OC(=O)C12CCC(CC1)(CC2)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nc(CC(O)=O)cs1 |r|
CS(=O)(=O)NC(=O)C12CCC(CC1)(CC2)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)sc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(15.8,-34.54,;14.31,-34.15,;13.91,-32.66,;12.42,-32.26,;11.35,-33.36,;11.74,-34.84,;13.22,-35.23,;9.86,-32.96,;8.77,-34.06,;7.28,-33.66,;9.18,-35.54,;10.62,-36.09,;10.54,-37.62,;10.94,-39.1,;12.41,-39.5,;13.5,-38.42,;13.11,-36.93,;11.62,-36.53,;9.06,-38.03,;8.12,-36.77,;6.78,-35.25,;6.48,-33.73,;5.03,-33.23,;3.87,-34.24,;4.16,-35.76,;3,-36.77,;5.62,-36.26,;6.93,-37,;9.97,-39.28,;11.38,-40.44,;9.07,-40.54,;7.59,-40.07,;6.11,-40.56,;5.19,-39.31,;3.65,-39.32,;6.1,-38.04,;7.58,-38.51,)|
CC1(C)CC2(C1)N[C@H]([C@H](c1cccc(Cl)c1F)[C@]21C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:17.20,8.9,31.35,wD:7.32,34.39,(50.67,-37.89,;49.19,-38.3,;50.28,-39.38,;47.86,-39.06,;47.1,-37.73,;48.43,-36.97,;47.17,-36.2,;45.73,-35.65,;44.68,-36.88,;43.34,-35.36,;43.04,-33.84,;41.58,-33.34,;40.42,-34.35,;40.72,-35.87,;39.55,-36.88,;42.17,-36.37,;43.86,-37.35,;45.61,-38.14,;46.53,-39.39,;47.93,-40.55,;45.62,-40.65,;44.14,-40.18,;42.8,-40.95,;41.47,-40.18,;40.14,-40.95,;41.47,-38.64,;42.8,-37.87,;44.14,-38.63,;45.33,-34.17,;43.84,-33.77,;46.41,-33.07,;47.9,-33.47,;48.97,-32.37,;50.47,-32.77,;50.87,-34.26,;52.35,-34.65,;49.78,-35.34,;48.3,-34.95,)|
CCN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)C(=O)NC12CCC(CC1)(CC2)C(O)=O |r|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1nc(Cl)ccc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(16.89,-6.16,;15.4,-5.76,;15,-4.28,;13.51,-3.87,;12.44,-4.97,;12.83,-6.46,;14.31,-6.85,;10.95,-4.58,;9.86,-5.67,;8.37,-5.28,;10.27,-7.16,;11.71,-7.7,;11.63,-9.24,;12.03,-10.72,;13.5,-11.12,;14.59,-10.04,;14.2,-8.55,;12.71,-8.15,;10.15,-9.65,;9.21,-8.39,;7.87,-6.87,;7.57,-5.35,;6.12,-4.85,;4.96,-5.86,;5.25,-7.38,;4.09,-8.39,;6.71,-7.88,;8.39,-8.86,;11.06,-10.9,;12.47,-12.06,;10.16,-12.16,;8.68,-11.69,;7.34,-12.46,;6.01,-11.69,;4.67,-12.46,;6.01,-10.15,;7.34,-9.38,;8.67,-10.14,)|
OC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)o1 |r|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nnc(C)o1 |r|
OC(=O)[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.33,21.24,6.9,wD:12.12,3.2,(33.7,-7.1,;33.4,-5.59,;34.56,-4.57,;31.94,-5.09,;31.64,-3.58,;30.18,-3.08,;29.04,-4.09,;29.33,-5.61,;30.78,-6.1,;27.58,-3.6,;26.42,-4.62,;24.99,-4.05,;26.8,-6.11,;28.24,-6.65,;28.17,-8.19,;28.56,-9.67,;30.04,-10.07,;31.13,-8.99,;30.73,-7.5,;29.25,-7.1,;26.68,-8.6,;25.75,-7.34,;24.41,-5.82,;24.11,-4.3,;22.65,-3.8,;21.49,-4.81,;21.79,-6.33,;20.62,-7.34,;23.24,-6.83,;24.93,-7.81,;27.6,-9.85,;29,-11.01,;26.69,-11.11,;25.22,-10.64,;23.87,-11.41,;22.54,-10.64,;21.21,-11.41,;22.54,-9.1,;23.87,-8.33,;25.21,-9.09,)|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nc(cs1)C(O)=O |r|
CC1(C)CCC2(CC1)N[C@H]([C@H](c1cccc(Cl)c1F)[C@]21C(=O)Nc2cc(Cl)ccc12)C(=O)Nc1ccc(cc1)C(O)=O |r|
OC(=O)[C@@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.33,21.24,6.9,3.2,wD:12.12,(33.42,-21.14,;33.12,-19.63,;34.28,-18.61,;31.66,-19.13,;31.36,-17.62,;29.9,-17.12,;28.75,-18.13,;29.05,-19.65,;30.5,-20.14,;27.3,-17.64,;26.14,-18.66,;24.71,-18.09,;26.52,-20.15,;27.96,-20.69,;27.88,-22.23,;28.28,-23.71,;29.76,-24.11,;30.85,-23.02,;30.45,-21.54,;28.96,-21.14,;26.4,-22.64,;25.46,-21.38,;24.13,-19.86,;23.83,-18.34,;22.37,-17.84,;21.21,-18.85,;21.5,-20.37,;20.34,-21.38,;22.96,-20.87,;24.64,-21.85,;27.31,-23.89,;28.72,-25.05,;26.41,-25.15,;24.93,-24.68,;23.59,-25.45,;22.26,-24.68,;20.93,-25.45,;22.26,-23.13,;23.59,-22.36,;24.92,-23.13,)|
NS(=O)(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
NC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCC(F)(F)CC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:20.33,21.24,4.7,wD:10.10,1.0,(51.95,-4.23,;50.46,-3.83,;50.06,-2.35,;48.57,-1.95,;47.5,-3.04,;47.89,-4.53,;49.37,-4.92,;46.01,-2.65,;44.92,-3.75,;43.43,-3.35,;45.33,-5.23,;46.77,-5.78,;46.69,-7.31,;47.09,-8.79,;48.56,-9.19,;49.65,-8.1,;51.14,-7.7,;50.75,-9.18,;49.26,-6.62,;47.77,-6.22,;45.21,-7.72,;44.27,-6.46,;42.93,-4.94,;42.63,-3.42,;41.18,-2.92,;40.02,-3.93,;40.31,-5.45,;39.15,-6.46,;41.77,-5.95,;43.45,-6.93,;46.12,-8.97,;47.53,-10.13,;45.22,-10.23,;43.74,-9.76,;42.4,-10.53,;41.07,-9.76,;39.73,-10.53,;41.07,-8.22,;42.4,-7.45,;43.73,-8.21,)|
OC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1F |r|
OC(=O)[C@H]1CC[C@H](CNC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)CC1 |r,wU:19.31,20.22,6.6,wD:11.10,3.2,(34.1,-31.43,;32.64,-30.93,;32.34,-29.42,;31.48,-31.94,;30.02,-31.45,;28.86,-32.46,;29.17,-33.97,;28.02,-34.98,;26.56,-34.49,;25.4,-35.51,;23.97,-34.95,;25.78,-37,;27.22,-37.55,;27.15,-39.08,;27.54,-40.57,;29.02,-40.96,;30.11,-39.88,;29.71,-38.4,;28.23,-37.99,;25.66,-39.49,;24.73,-38.23,;23.39,-36.71,;23.09,-35.19,;21.63,-34.7,;20.47,-35.71,;20.77,-37.22,;19.6,-38.23,;22.22,-37.72,;23.91,-38.71,;26.58,-40.74,;27.98,-41.9,;25.67,-42,;24.2,-41.53,;22.86,-42.3,;21.52,-41.53,;20.19,-42.3,;21.52,-39.99,;22.85,-39.22,;24.19,-39.98,;30.63,-34.46,;31.78,-33.45,)|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1nc(Cl)ncc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(16.85,-19.98,;15.36,-19.58,;14.96,-18.09,;13.47,-17.69,;12.4,-18.79,;12.79,-20.27,;14.27,-20.66,;10.91,-18.39,;9.82,-19.49,;8.33,-19.1,;10.23,-20.97,;11.67,-21.52,;11.59,-23.05,;11.99,-24.54,;13.46,-24.93,;14.55,-23.85,;14.16,-22.37,;12.67,-21.96,;10.11,-23.46,;9.17,-22.2,;7.83,-20.68,;7.53,-19.16,;6.08,-18.67,;4.92,-19.68,;5.21,-21.19,;4.05,-22.2,;6.67,-21.69,;8.35,-22.68,;11.02,-24.71,;12.43,-25.87,;10.12,-25.97,;8.64,-25.5,;7.3,-26.27,;5.97,-25.5,;4.63,-26.27,;5.97,-23.96,;7.3,-23.19,;8.63,-23.95,)|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)c1nc(co1)C(O)=O |r|
O[C@H]1CC[C@@H](CC1)NC(=O)[C@@H]1NC2(CCOCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r,wU:18.31,19.22,4.7,wD:10.10,1.0,(33.83,-35.84,;32.35,-35.44,;31.95,-33.95,;30.45,-33.55,;29.38,-34.65,;29.78,-36.14,;31.26,-36.53,;27.89,-34.26,;26.81,-35.35,;25.32,-34.96,;27.21,-36.84,;28.65,-37.38,;28.58,-38.91,;28.97,-40.4,;30.45,-40.8,;31.54,-39.71,;31.14,-38.23,;29.66,-37.83,;27.09,-39.32,;26.15,-38.07,;24.82,-36.55,;24.52,-35.03,;23.06,-34.53,;21.9,-35.54,;22.2,-37.06,;21.03,-38.06,;23.65,-37.56,;25.34,-38.54,;28.01,-40.58,;29.41,-41.74,;27.1,-41.84,;25.62,-41.37,;24.28,-42.14,;22.95,-41.37,;21.62,-42.14,;22.95,-39.82,;24.28,-39.05,;25.62,-39.82,)|
CN1[C@H]([C@H](c2cccc(Cl)c2F)[C@]2(C(=O)Nc3cc(Cl)ccc23)C11CCCCC1)C(=O)NC12CCC(CC1)(CC2)C(O)=O |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCCCC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NC1CCS(=O)(=O)CC1 |r|
OC(=O)C12CC(C1)(C2)NC(=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21 |r|
OC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)c(F)c1 |r|
c1ccc(c(c1)O)O
C1=CC(=O)C=CC1=O
CN1CCc2cccc-3c2[C@@H]1Cc1ccc(O)c(O)c-31
CN1CCc2cccc-3c2[C@H]1Cc4c3c(c(cc4)O)O
CN1CCc2cccc3c4C(=O)C(=O)C=Cc4cc1c23 |c:14|
CC(C)C[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
COc1ccc(C2=N[C@@H]([C@@H](N2C(=O)N2CCNC(=O)C2)c2ccc(Cl)cc2)c2ccc(Cl)cc2)c(OC(C)C)c1 |r,t:6|
CCOc1cc(\C=C2\C(C)=NN(C2=O)c2ccccc2)cc(Cl)c1OCC(=O)OC |c:9|
CC(CC(=O)N[C@@H](Cc1ccc(OCCCNc2ccccn2)cc1)C(O)=O)c1ccccc1 |r|
OC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)Oc1ccc(C[C@H](NC(=O)CC(c2ccccc2)c2ccccc2)C(O)=O)cc1 |r|
Nc1ccc(C[C@H](NC(=O)CC(c2ccccc2)c2ccccc2)C(O)=O)cc1 |r|
OC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
OC(=O)[C@H](Cc1ccccc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CC(c1ccccc1)(c1ccccc1)c1ccccc1 |r|
OC(=O)[C@H](Cc1ccc(OCCCNc2ccccn2)cc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
OC(=O)[C@H](Cc1ccc(cc1)[N+]([O-])=O)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
OC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)CC(c1ccccc1)c1ccccc1 |r|
OC(=O)[C@H](Cc1ccc(OCCCNc2ccccn2)cc1)NC(=O)CC(c1ccccc1)(c1ccccc1)c1ccccc1 |r|
COC(=O)C[C@@H]1CS[C@@]2([C@@H]([C@H]1CNc1ccccc1F)c1ccc(Br)cc1)C(=O)Nc1cccc(Br)c21 |r|
COC(=O)C[C@@H]1CS[C@@]2([C@@H]([C@H]1CNc1cccc(F)c1)c1ccc(Br)cc1)C(=O)Nc1cccc(Br)c21 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1cccc(F)c1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(Cl)cc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccccc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(OCC)cc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1cccc(OCC)c1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(C)cc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(F)cc1F)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(cc1)-c1ccccc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(cc1)N1CCOCC1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(cc1)N(CC)CC)C(=O)Nc1cccc(Br)c31 |r|
OCC[C@@H]1CS[C@@]2([C@@H]([C@H]1CO)c1ccc(Br)cc1)C(=O)Nc1cccc(Br)c21 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccccc1F)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(F)cc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(OC)cc1)C(=O)Nc1cccc(Br)c31 |r|
[H][C@@]12CS[C@@]3([C@H](c4ccc(Br)cc4)[C@@]1([H])CN(C(=O)C2)c1ccc(cc1)N1CCN(C)CC1)C(=O)Nc1cccc(Br)c31 |r|
COC(=O)C[C@@H]1CS[C@@]2([C@@H]([C@H]1C=O)c1ccc(Br)cc1)C(=O)Nc1cccc(Br)c21 |r|
CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H]([C@H](C)O)C(=O)N1CCC[C@H]1C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(O)=O |r|
COc1ccc(C2=NC(C(N2)c2ccc(Cl)cc2)c2ccc(Cl)cc2)c(OC(C)C)c1 |t:6|
NNC(=O)CCCCCCCCCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1
OC(=O)CCC(=O)NCCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(13.19,-25.49,;13.93,-24.13,;13.12,-22.82,;15.47,-24.08,;16.2,-22.73,;15.39,-21.42,;13.85,-21.46,;16.12,-20.07,;17.66,-20.02,;18.39,-18.66,;19.93,-18.61,;20.66,-17.26,;19.85,-15.95,;22.2,-17.21,;23.14,-18.43,;24.59,-17.92,;25.95,-18.64,;27.26,-17.84,;28.62,-18.56,;27.22,-16.3,;25.86,-15.56,;24.55,-16.38,;23.07,-15.95,;22.55,-14.49,;23.42,-13.22,;22.48,-12,;21.03,-12.52,;21.07,-14.06,;19.85,-15,;18.43,-14.42,;17.21,-15.36,;15.78,-14.77,;15.58,-13.25,;14.15,-12.66,;16.8,-12.3,;18.22,-12.89,;24.96,-13.18,;25.69,-11.82,;27.23,-11.78,;28.04,-13.09,;29.58,-13.04,;27.3,-14.44,;25.77,-14.49,)|
OC(=O)CCC(=O)OCCCCCCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(11.56,-10.6,;12.33,-11.94,;11.56,-13.27,;13.87,-11.94,;14.64,-13.27,;16.18,-13.27,;16.95,-11.94,;16.95,-14.6,;18.49,-14.6,;19.26,-15.94,;20.8,-15.94,;21.57,-17.27,;23.11,-17.27,;23.88,-18.6,;25.42,-18.6,;26.19,-17.27,;25.42,-15.94,;27.73,-17.27,;28.64,-18.52,;30.1,-18.04,;31.43,-18.81,;32.77,-18.04,;34.1,-18.81,;32.77,-16.5,;31.43,-15.73,;30.1,-16.5,;28.64,-16.02,;28.16,-14.56,;29.06,-13.31,;28.16,-12.07,;26.69,-12.54,;26.69,-14.08,;25.45,-14.98,;24.04,-14.36,;22.8,-15.27,;21.39,-14.64,;21.23,-13.11,;19.82,-12.48,;22.48,-12.2,;23.88,-12.83,;30.6,-13.31,;31.37,-11.98,;32.91,-11.98,;33.68,-13.31,;35.22,-13.31,;32.91,-14.65,;31.37,-14.65,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(OCc2ccccc2Br)cc1)-c1ccc(F)cc1 |(20.01,-19.68,;21.19,-18.7,;20.93,-17.18,;22.64,-19.23,;23.05,-20.72,;24.6,-20.78,;25.59,-21.97,;27.11,-21.72,;28.09,-22.91,;27.65,-20.27,;26.66,-19.08,;25.14,-19.34,;23.92,-18.37,;23.99,-16.83,;25.26,-15.97,;24.87,-14.5,;23.32,-14.44,;22.76,-15.82,;21.27,-16.2,;20.14,-15.16,;20.48,-13.63,;19.38,-12.59,;17.9,-13.06,;16.76,-12.01,;15.28,-12.47,;14.94,-13.98,;16.08,-15.01,;15.74,-16.51,;14.27,-16.97,;13.13,-15.92,;13.48,-14.42,;12.36,-13.37,;17.57,-14.55,;18.7,-15.59,;26.71,-16.49,;26.97,-18.01,;28.42,-18.53,;29.6,-17.54,;31.03,-18.06,;29.32,-16.02,;27.87,-15.5,)|
OC(=O)CCC(=O)NCCCCCCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(9.15,-11.62,;9.92,-12.95,;9.15,-14.28,;11.46,-12.95,;12.23,-14.28,;13.77,-14.28,;14.54,-12.95,;14.54,-15.62,;16.08,-15.62,;16.85,-16.95,;18.39,-16.95,;19.16,-18.29,;20.7,-18.29,;21.47,-19.62,;23.01,-19.62,;23.78,-18.29,;23.01,-16.95,;25.32,-18.29,;26.23,-19.53,;27.69,-19.06,;29.02,-19.83,;30.36,-19.06,;31.69,-19.83,;30.36,-17.52,;29.02,-16.75,;27.69,-17.52,;26.23,-17.04,;25.75,-15.57,;26.65,-14.33,;25.75,-13.08,;24.28,-13.56,;24.28,-15.1,;23.04,-16,;21.63,-15.38,;20.39,-16.28,;18.98,-15.66,;18.82,-14.12,;17.41,-13.49,;20.07,-13.22,;21.47,-13.85,;28.19,-14.33,;28.96,-13,;30.5,-13,;31.27,-14.33,;32.81,-14.33,;30.5,-15.66,;28.96,-15.66,)|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(F)c(F)c1)-c1ccc(F)cc1 |(17.08,-19.16,;17.85,-17.83,;17.08,-16.49,;17.85,-15.17,;17.08,-13.82,;19.39,-15.17,;20.29,-16.42,;21.76,-15.92,;23.1,-16.69,;24.43,-15.92,;25.76,-16.69,;24.42,-14.37,;23.09,-13.61,;21.76,-14.39,;20.29,-13.91,;19.81,-12.44,;20.71,-11.21,;19.81,-9.96,;18.35,-10.43,;18.35,-11.98,;17.1,-12.89,;15.69,-12.26,;15.53,-10.73,;14.12,-10.11,;12.88,-11.01,;11.47,-10.39,;13.04,-12.55,;11.8,-13.45,;14.45,-13.17,;22.26,-11.21,;23.02,-12.55,;24.56,-12.55,;25.34,-11.22,;26.88,-11.22,;24.57,-9.88,;23.03,-9.88,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(F)c(F)c1)-c1ccc(F)cc1 |(17.08,-16.49,;17.85,-15.17,;17.08,-13.82,;19.39,-15.17,;20.29,-16.42,;21.76,-15.92,;23.1,-16.69,;24.43,-15.92,;25.76,-16.69,;24.42,-14.37,;23.09,-13.61,;21.76,-14.39,;20.29,-13.91,;19.81,-12.44,;20.72,-11.21,;19.81,-9.96,;18.35,-10.43,;18.35,-11.98,;17.1,-12.89,;15.69,-12.26,;15.53,-10.73,;14.12,-10.11,;12.88,-11.01,;11.47,-10.39,;13.04,-12.55,;11.8,-13.45,;14.45,-13.17,;22.26,-11.21,;23.02,-12.55,;24.56,-12.55,;25.34,-11.22,;26.88,-11.22,;24.57,-9.88,;23.03,-9.88,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(OCc2cc(F)cc(F)c2)cc1)-c1ccc(F)cc1 |(17.67,-17.78,;18.44,-16.46,;17.67,-15.11,;19.98,-16.46,;20.88,-17.71,;22.35,-17.21,;23.69,-17.98,;25.02,-17.21,;26.35,-17.98,;25.01,-15.66,;23.68,-14.9,;22.34,-15.68,;20.88,-15.2,;20.4,-13.73,;21.3,-12.5,;20.4,-11.25,;18.94,-11.72,;18.94,-13.27,;17.69,-14.18,;16.28,-13.55,;16.12,-12.02,;14.71,-11.4,;13.47,-12.3,;12.06,-11.68,;10.82,-12.58,;9.41,-11.96,;9.25,-10.43,;7.85,-9.8,;7.68,-8.27,;6.6,-10.71,;6.77,-12.25,;5.52,-13.16,;8.17,-12.87,;13.63,-13.84,;15.04,-14.46,;22.84,-12.5,;23.61,-13.84,;25.15,-13.84,;25.93,-12.51,;27.47,-12.51,;25.16,-11.17,;23.62,-11.17,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(OCc2cc(F)c(F)c(F)c2)cc1)-c1ccc(F)cc1 |(19.25,-22.18,;20.01,-20.86,;19.25,-19.51,;21.55,-20.86,;22.46,-22.11,;23.93,-21.61,;25.27,-22.38,;26.6,-21.61,;27.93,-22.38,;26.59,-20.06,;25.26,-19.3,;23.92,-20.08,;22.45,-19.6,;21.98,-18.14,;22.88,-16.9,;21.98,-15.65,;20.51,-16.13,;20.51,-17.67,;19.27,-18.58,;17.86,-17.95,;17.7,-16.43,;16.29,-15.8,;15.05,-16.7,;13.64,-16.08,;12.4,-16.99,;10.99,-16.36,;10.83,-14.83,;9.42,-14.2,;9.26,-12.67,;8.18,-15.11,;6.77,-14.49,;8.34,-16.65,;7.1,-17.56,;9.75,-17.27,;15.21,-18.24,;16.62,-18.86,;24.42,-16.9,;25.19,-18.24,;26.73,-18.24,;27.5,-16.91,;29.04,-16.91,;26.74,-15.58,;25.2,-15.57,)|
Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)NCc1ccc(F)c(F)c1 |(29.37,-12.48,;27.83,-12.48,;27.06,-11.15,;25.52,-11.15,;24.75,-12.48,;25.52,-13.81,;27.06,-13.81,;23.21,-12.48,;22.3,-11.24,;20.84,-11.71,;20.84,-13.25,;19.59,-14.16,;18.18,-13.53,;16.94,-14.43,;15.53,-13.81,;15.37,-12.28,;13.96,-11.65,;16.61,-11.37,;18.02,-11.99,;22.3,-13.73,;22.77,-15.19,;21.87,-16.44,;22.77,-17.68,;24.24,-17.21,;25.57,-17.98,;26.91,-17.21,;28.24,-17.98,;26.91,-15.67,;25.57,-14.9,;24.24,-15.67,;20.33,-16.44,;19.56,-15.11,;19.56,-17.77,;18.02,-17.77,;17.25,-19.11,;15.71,-19.11,;14.94,-20.44,;15.71,-21.77,;14.94,-23.11,;17.25,-21.77,;18.02,-23.11,;18.02,-20.44,)|
CCOC(=O)C1CCN(CC1)C(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(17.26,-24.64,;16.49,-23.3,;17.26,-21.97,;16.49,-20.64,;14.95,-20.64,;17.26,-19.3,;18.8,-19.3,;19.57,-17.97,;18.8,-16.64,;17.26,-16.64,;16.49,-17.97,;19.57,-15.3,;18.8,-13.96,;21.11,-15.3,;22.02,-16.55,;23.48,-16.07,;24.82,-16.84,;26.14,-16.07,;27.48,-16.84,;26.14,-14.53,;24.82,-13.76,;23.48,-14.53,;22.02,-14.06,;21.54,-12.59,;22.45,-11.34,;21.54,-10.1,;20.08,-10.57,;20.08,-12.11,;18.83,-13.02,;17.42,-12.4,;16.18,-13.3,;14.77,-12.67,;14.61,-11.14,;13.2,-10.51,;15.85,-10.24,;17.26,-10.86,;23.99,-11.34,;24.76,-10.01,;26.3,-10.01,;27.07,-11.34,;28.61,-11.34,;26.3,-12.68,;24.76,-12.68,)|
Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)Nc1ccc(cc1)N1CCOCC1 |(28.53,-12.05,;26.99,-12.05,;26.22,-10.71,;24.68,-10.71,;23.91,-12.05,;24.68,-13.39,;26.22,-13.39,;22.37,-12.05,;21.47,-10.81,;20.01,-11.28,;20.01,-12.82,;18.76,-13.73,;17.35,-13.1,;16.1,-14.01,;14.7,-13.38,;14.54,-11.85,;13.13,-11.22,;15.79,-10.95,;17.19,-11.57,;21.47,-13.29,;21.95,-14.77,;21.04,-16.01,;21.95,-17.26,;23.41,-16.78,;24.74,-17.55,;26.08,-16.78,;27.42,-17.55,;26.08,-15.24,;24.74,-14.47,;23.41,-15.24,;19.5,-16.01,;18.73,-14.67,;18.73,-17.34,;17.19,-17.34,;16.42,-18.68,;14.88,-18.68,;14.12,-17.34,;14.88,-16.01,;16.42,-16.01,;12.58,-17.34,;11.81,-18.68,;10.27,-18.68,;9.5,-17.34,;10.27,-16.01,;11.81,-16.01,)|
Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)N1CCC(CC1)N1CCOCC1 |(30,-14.56,;28.46,-14.56,;27.69,-13.23,;26.15,-13.23,;25.38,-14.56,;26.15,-15.9,;27.69,-15.9,;23.84,-14.56,;22.94,-13.32,;21.47,-13.79,;21.47,-15.33,;20.22,-16.24,;18.82,-15.61,;17.57,-16.52,;16.17,-15.9,;16.01,-14.36,;14.6,-13.73,;17.25,-13.46,;18.66,-14.08,;22.94,-15.81,;23.41,-17.27,;22.51,-18.52,;23.41,-19.77,;24.88,-19.29,;26.21,-20.06,;27.55,-19.29,;28.88,-20.06,;27.55,-17.75,;26.21,-16.98,;24.88,-17.75,;20.97,-18.52,;20.2,-17.19,;20.2,-19.85,;20.97,-21.19,;20.2,-22.52,;18.66,-22.52,;17.89,-21.19,;18.66,-19.85,;17.89,-23.85,;18.66,-25.19,;17.89,-26.52,;16.35,-26.52,;15.58,-25.19,;16.35,-23.85,)|
CCN(CC)CCNC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(14.1,-21.32,;15.64,-21.32,;16.41,-22.65,;15.64,-23.99,;16.41,-25.32,;17.95,-22.65,;18.71,-21.32,;20.25,-21.32,;21.02,-19.99,;20.25,-18.65,;22.56,-19.99,;23.47,-21.23,;24.93,-20.76,;26.27,-21.53,;27.6,-20.76,;28.94,-21.53,;27.6,-19.22,;26.27,-18.45,;24.93,-19.22,;23.47,-18.74,;22.99,-17.27,;23.89,-16.02,;22.99,-14.78,;21.53,-15.25,;21.53,-16.79,;20.28,-17.71,;18.87,-17.08,;17.63,-17.98,;16.22,-17.36,;16.06,-15.82,;14.66,-15.2,;17.31,-14.92,;18.72,-15.54,;25.43,-16.02,;26.2,-14.69,;27.74,-14.69,;28.51,-16.02,;30.05,-16.02,;27.74,-17.36,;26.2,-17.36,)|
Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |(29.62,-14.08,;28.08,-14.08,;27.31,-12.75,;25.77,-12.75,;25,-14.08,;25.77,-15.42,;27.31,-15.42,;23.46,-14.08,;22.55,-12.84,;21.09,-13.31,;21.09,-14.85,;19.84,-15.75,;18.43,-15.13,;17.19,-16.04,;15.78,-15.41,;15.62,-13.88,;14.21,-13.25,;16.86,-12.97,;18.27,-13.6,;22.55,-15.33,;23.02,-16.79,;22.12,-18.04,;23.02,-19.29,;24.49,-18.81,;25.82,-19.58,;27.16,-18.81,;28.49,-19.58,;27.16,-17.27,;25.82,-16.5,;24.49,-17.27,;20.58,-18.04,;19.81,-16.71,;19.81,-19.37,;18.27,-19.37,;17.5,-20.71,;15.96,-20.71,;15.19,-22.04,;13.65,-22.04,;12.88,-20.71,;13.65,-19.37,;15.19,-19.37,)|
Fc1ccc(cc1)-c1ncn(Cc2ccc(Cl)cc2)c1-c1c([nH]c2cc(Cl)ccc12)C(=O)OCCN1CCOCC1 |(30.21,-12.02,;28.67,-12.02,;27.9,-10.69,;26.36,-10.69,;25.59,-12.02,;26.36,-13.35,;27.9,-13.35,;24.05,-12.02,;23.14,-10.78,;21.68,-11.25,;21.68,-12.79,;20.43,-13.69,;19.02,-13.07,;17.78,-13.98,;16.37,-13.35,;16.21,-11.82,;14.8,-11.19,;17.45,-10.91,;18.86,-11.54,;23.14,-13.27,;23.61,-14.73,;22.71,-15.98,;23.61,-17.23,;25.08,-16.75,;26.41,-17.52,;27.75,-16.75,;29.08,-17.52,;27.75,-15.21,;26.41,-14.44,;25.08,-15.21,;21.17,-15.98,;20.4,-14.65,;20.4,-17.31,;18.86,-17.31,;18.09,-18.65,;16.55,-18.65,;15.78,-19.98,;14.24,-19.98,;13.47,-18.65,;14.24,-17.31,;15.78,-17.31,)|
OCCCCCCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(12.66,-16.37,;14.2,-16.37,;14.97,-17.7,;16.51,-17.7,;17.28,-19.04,;18.82,-19.04,;19.59,-20.38,;21.13,-20.38,;21.9,-19.04,;21.13,-17.7,;23.44,-19.04,;24.34,-20.28,;25.81,-19.81,;27.14,-20.58,;28.48,-19.81,;29.81,-20.58,;28.48,-18.27,;27.14,-17.5,;25.81,-18.27,;24.34,-17.79,;23.87,-16.33,;24.77,-15.08,;23.87,-13.83,;22.4,-14.31,;22.4,-15.85,;21.16,-16.76,;19.75,-16.14,;18.5,-17.04,;17.1,-16.41,;16.94,-14.87,;15.53,-14.25,;18.18,-13.97,;19.59,-14.6,;26.31,-15.08,;27.08,-13.75,;28.62,-13.75,;29.39,-15.08,;30.93,-15.08,;28.62,-16.41,;27.08,-16.41,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)-c1ccc(F)cc1 |(20.17,-21.62,;20.94,-20.3,;20.17,-18.95,;22.48,-20.3,;23.38,-21.55,;24.85,-21.05,;26.19,-21.82,;27.53,-21.05,;28.85,-21.82,;27.52,-19.51,;26.19,-18.74,;24.85,-19.52,;23.38,-19.04,;22.9,-17.58,;23.81,-16.34,;22.91,-15.09,;21.44,-15.57,;21.44,-17.11,;20.19,-18.02,;18.79,-17.39,;18.63,-15.87,;17.22,-15.24,;15.97,-16.14,;14.57,-15.52,;13.32,-16.43,;11.91,-15.8,;10.68,-16.71,;9.27,-16.09,;9.1,-14.55,;7.69,-13.93,;10.35,-13.64,;10.19,-12.11,;11.76,-14.27,;16.14,-17.68,;17.54,-18.3,;25.35,-16.34,;26.11,-17.68,;27.65,-17.68,;28.43,-16.35,;29.97,-16.35,;27.66,-15.02,;26.12,-15.01,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(14.91,-19.06,;15.68,-20.39,;14.91,-21.72,;17.22,-20.39,;18.12,-21.64,;19.59,-21.16,;20.92,-21.93,;22.25,-21.16,;23.59,-21.93,;22.25,-19.62,;20.92,-18.85,;19.59,-19.62,;18.12,-19.15,;17.64,-17.68,;18.56,-16.44,;17.64,-15.19,;16.19,-15.67,;16.19,-17.21,;14.94,-18.11,;13.53,-17.48,;12.28,-18.39,;10.88,-17.77,;10.72,-16.23,;9.31,-15.61,;11.96,-15.33,;13.37,-15.96,;20.1,-16.44,;20.86,-17.78,;22.4,-17.78,;23.17,-16.44,;24.71,-16.44,;22.39,-15.1,;20.85,-15.11,)|
COC(=O)c1ccc(CNC(=O)c2[nH]c3cc(Cl)ccc3c2-c2c(ncn2Cc2ccc(Cl)cc2)-c2ccc(F)cc2)cc1 |(12.14,-21.66,;12.91,-22.99,;14.45,-22.98,;15.23,-24.31,;15.22,-21.64,;14.44,-20.31,;15.21,-18.98,;16.75,-18.97,;17.51,-17.64,;19.04,-17.63,;19.81,-16.29,;19.03,-14.96,;21.35,-16.29,;22.26,-17.52,;23.72,-17.05,;25.06,-17.81,;26.39,-17.03,;27.72,-17.8,;26.37,-15.49,;25.04,-14.73,;23.71,-15.51,;22.25,-15.03,;21.76,-13.57,;22.67,-12.33,;21.75,-11.08,;20.29,-11.57,;20.3,-13.11,;19.06,-14.02,;17.65,-13.4,;16.41,-14.31,;15,-13.69,;14.83,-12.16,;13.42,-11.54,;16.07,-11.25,;17.48,-11.87,;24.2,-12.32,;24.96,-10.98,;26.5,-10.98,;27.28,-12.31,;28.82,-12.3,;26.51,-13.64,;24.98,-13.65,;17.52,-20.3,;16.76,-21.64,)|
OC(=O)c1ccc(CNC(=O)c2[nH]c3cc(Cl)ccc3c2-c2c(ncn2Cc2ccc(Cl)cc2)-c2ccc(F)cc2)cc1 |(10.42,-22.35,;11.96,-22.35,;12.74,-23.68,;12.72,-21.02,;11.95,-19.68,;12.71,-18.35,;14.25,-18.34,;15.01,-17.01,;16.55,-17,;17.32,-15.67,;16.54,-14.33,;18.85,-15.66,;19.75,-16.91,;21.21,-16.42,;22.56,-17.17,;23.87,-16.4,;25.21,-17.16,;23.86,-14.86,;22.54,-14.1,;21.21,-14.89,;19.75,-14.4,;19.27,-12.95,;20.17,-11.7,;19.26,-10.47,;17.8,-10.94,;17.8,-12.48,;16.57,-13.39,;15.17,-12.77,;13.93,-13.69,;12.51,-13.07,;12.35,-11.54,;10.95,-10.91,;13.58,-10.63,;15,-11.24,;21.71,-11.7,;22.46,-10.36,;24,-10.35,;24.77,-11.69,;26.31,-11.67,;24.01,-13.01,;22.47,-13.03,;15.02,-19.67,;14.26,-21.01,)|
CN1CCN(CC1)C(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(ncn1Cc1ccc(Cl)cc1)-c1ccc(F)cc1 |(16.72,-22.63,;17.49,-21.31,;19.03,-21.31,;19.8,-19.97,;19.03,-18.63,;17.49,-18.63,;16.72,-19.97,;19.8,-17.3,;19.03,-15.97,;21.34,-17.3,;22.24,-18.55,;23.71,-18.07,;25.05,-18.84,;26.38,-18.07,;27.71,-18.84,;26.38,-16.53,;25.05,-15.76,;23.71,-16.53,;22.24,-16.05,;21.77,-14.59,;22.68,-13.34,;21.77,-12.1,;20.31,-12.57,;20.31,-14.11,;19.06,-15.02,;17.65,-14.39,;16.41,-15.3,;15,-14.67,;14.84,-13.14,;13.43,-12.52,;16.08,-12.23,;17.49,-12.86,;24.22,-13.34,;24.99,-12.01,;26.53,-12.01,;27.3,-13.34,;28.84,-13.34,;26.53,-14.68,;24.99,-14.68,)|
CC[C@@H]([C@H](C)O)N1[C@@H]([C@H](C[C@](C1=O)(C)CC(=O)O)c2cccc(c2)Cl)c3ccc(cc3)Cl
CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)NC(=O)[C@H](N)[C@@H](C)O)C(=O)N[C@H](CCCN=C(N)N)C(O)=O |r,wU:91.96,84.88,58.68,45.50,25.30,8.12,97.100,wD:89.93,70.84,53.54,34.42,16.21,4.4,(32.72,5.46,;32.72,3.92,;34.05,3.15,;31.38,3.14,;31.38,1.6,;30.05,.83,;28.71,1.6,;28.72,3.14,;27.38,.83,;27.39,-.71,;28.72,-1.48,;28.72,-3.03,;30.05,-.71,;26.05,1.6,;24.71,.83,;24.72,-.71,;23.38,1.6,;23.38,3.14,;24.72,3.92,;24.72,5.46,;26.05,6.22,;26.04,7.8,;22.05,.82,;20.71,1.6,;20.71,3.14,;19.38,.83,;19.38,-.71,;20.71,-1.48,;20.72,-3.02,;19.38,-3.79,;22.05,-3.79,;18.04,1.6,;16.7,.82,;16.7,-.72,;15.37,1.59,;15.37,3.13,;16.7,3.91,;18.04,3.14,;19.37,3.92,;19.37,5.46,;18.04,6.22,;16.7,5.45,;14.04,.83,;12.71,1.6,;12.71,3.14,;11.37,.82,;11.37,-.72,;12.71,-1.48,;14.04,-.71,;12.71,-3.03,;10.04,1.6,;8.7,.82,;8.7,-.72,;7.36,1.59,;7.36,3.14,;6.03,.82,;4.7,1.59,;4.7,3.14,;3.36,.82,;3.36,-.72,;4.7,-1.48,;6.03,-.72,;7.36,-1.49,;7.36,-3.03,;8.7,-3.8,;6.04,-3.8,;4.7,-3.03,;2.03,1.59,;.69,.82,;.69,-.72,;-.64,1.59,;-.63,3.13,;.7,3.91,;2.1,3.28,;3.13,4.42,;2.35,5.76,;2.83,7.23,;1.8,8.38,;.3,8.06,;-.18,6.58,;.85,5.44,;-1.97,.82,;-3.31,1.59,;-3.31,3.13,;-4.64,.82,;-4.64,-.72,;-5.97,1.6,;-7.31,.82,;-7.31,-.72,;-8.65,1.59,;-9.98,.82,;-8.65,3.13,;-9.98,3.9,;-7.32,3.9,;32.72,.83,;32.72,-.71,;34.06,1.61,;35.39,.84,;35.39,-.71,;36.72,-1.47,;36.72,-3.01,;38.06,-3.79,;38.06,-5.33,;36.73,-6.1,;39.4,-6.1,;36.73,1.6,;38.06,.83,;36.72,3.14,)|
CC(C)C[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H](C)NC(=O)[C@H](N)[C@@H](C)O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCN=C(N)N)C(O)=O |r,wU:84.89,77.81,50.60,37.42,17.22,4.4,98.101,wD:82.86,62.77,45.46,26.34,8.13,90.93,(30.19,-17.41,;30.2,-15.86,;31.53,-15.1,;28.87,-15.09,;28.86,-13.55,;27.52,-12.78,;26.19,-13.56,;26.2,-15.1,;24.85,-12.79,;24.85,-11.25,;26.19,-10.46,;26.19,-8.92,;27.53,-8.17,;27.52,-6.6,;23.53,-13.56,;22.19,-12.78,;22.19,-11.24,;20.86,-13.56,;20.86,-15.1,;22.19,-15.86,;22.19,-17.4,;20.86,-18.17,;23.53,-18.18,;19.52,-12.79,;18.18,-13.56,;18.18,-15.1,;16.85,-12.79,;16.85,-11.25,;18.18,-10.47,;19.52,-11.25,;20.85,-10.46,;20.85,-8.92,;19.52,-8.17,;18.18,-8.94,;15.52,-13.56,;14.18,-12.79,;14.18,-11.25,;12.84,-13.56,;12.85,-15.1,;14.19,-15.86,;15.52,-15.1,;14.18,-17.41,;11.51,-12.79,;10.17,-13.56,;10.18,-15.1,;8.84,-12.79,;8.84,-11.25,;7.51,-13.56,;6.18,-12.79,;6.18,-11.25,;4.84,-13.56,;4.84,-15.1,;6.18,-15.87,;7.51,-15.1,;8.84,-15.88,;8.84,-17.42,;10.18,-18.18,;7.51,-18.18,;6.18,-17.41,;3.5,-12.79,;2.17,-13.56,;2.17,-15.1,;.84,-12.79,;.84,-11.25,;2.17,-10.48,;3.58,-11.1,;4.61,-9.96,;3.83,-8.62,;4.31,-7.15,;3.28,-6,;3.75,-4.54,;1.77,-6.33,;1.3,-7.8,;2.33,-8.95,;-.5,-13.56,;-1.84,-12.79,;-1.83,-11.25,;-3.17,-13.56,;-3.16,-15.11,;-4.5,-12.79,;-5.83,-13.56,;-5.83,-15.1,;-7.17,-12.79,;-8.5,-13.57,;-7.17,-11.25,;-8.5,-10.49,;-5.84,-10.49,;30.19,-12.79,;30.19,-11.25,;31.53,-13.56,;32.86,-12.78,;32.86,-11.24,;34.2,-10.46,;34.2,-8.92,;35.53,-11.23,;34.2,-13.55,;34.2,-15.09,;35.54,-12.77,;36.87,-13.54,;36.87,-15.1,;38.2,-15.85,;38.2,-17.39,;39.54,-18.17,;39.54,-19.71,;38.21,-20.48,;40.88,-20.48,;38.21,-12.78,;39.54,-13.55,;38.19,-11.24,)|
CC(C)C[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccc(cc1)C(F)(F)F)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)NC(=O)[C@H](N)[C@@H](C)O)C(=O)N[C@H](CCCN=C(N)N)C(O)=O |r,wU:95.100,88.92,62.72,49.54,25.30,8.12,101.104,wD:93.97,74.88,57.58,34.46,16.21,4.4,(33.04,-24.32,;33.04,-25.86,;34.37,-26.63,;31.7,-26.65,;31.7,-28.19,;30.37,-28.96,;29.03,-28.19,;29.03,-26.65,;27.7,-28.96,;27.71,-30.5,;29.04,-31.27,;29.04,-32.81,;30.37,-30.5,;26.36,-28.18,;25.03,-28.96,;25.04,-30.5,;23.7,-28.19,;23.7,-26.65,;25.04,-25.87,;25.04,-24.33,;26.37,-23.57,;26.36,-22,;22.37,-28.96,;21.03,-28.19,;21.03,-26.65,;19.7,-28.96,;19.7,-30.5,;21.03,-31.26,;21.03,-32.8,;19.7,-33.58,;22.37,-33.58,;18.36,-28.19,;17.02,-28.96,;17.02,-30.5,;15.69,-28.19,;15.69,-26.65,;17.02,-25.88,;17.02,-24.34,;18.36,-23.57,;19.69,-24.33,;19.69,-25.87,;18.36,-26.65,;21.02,-23.55,;22.36,-24.32,;21.02,-22.01,;22.35,-22.77,;14.36,-28.96,;13.02,-28.19,;13.03,-26.65,;11.68,-28.96,;11.69,-30.5,;13.03,-31.27,;14.36,-30.5,;13.03,-32.81,;10.35,-28.19,;9.02,-28.96,;9.02,-30.5,;7.68,-28.19,;7.68,-26.65,;6.35,-28.96,;5.02,-28.19,;5.02,-26.65,;3.68,-28.96,;3.68,-30.5,;5.02,-31.27,;6.35,-30.5,;7.68,-31.28,;7.68,-32.82,;9.02,-33.58,;6.35,-33.58,;5.02,-32.82,;2.34,-28.19,;1.01,-28.96,;1.01,-30.5,;-.32,-28.19,;-.32,-26.65,;1.02,-25.88,;2.42,-26.5,;3.45,-25.36,;2.67,-24.02,;3.15,-22.55,;2.12,-21.41,;.61,-21.74,;.14,-23.2,;1.17,-24.35,;-1.66,-28.96,;-2.99,-28.19,;-2.99,-26.65,;-4.33,-28.97,;-4.32,-30.51,;-5.65,-28.19,;-6.99,-28.97,;-6.99,-30.5,;-8.33,-28.19,;-9.66,-28.97,;-8.33,-26.65,;-9.66,-25.89,;-7,-25.89,;33.04,-28.96,;33.04,-30.5,;34.38,-28.18,;35.71,-28.95,;35.71,-30.5,;37.04,-31.26,;37.04,-32.79,;38.38,-33.57,;38.38,-35.11,;37.05,-35.89,;39.72,-35.89,;37.05,-28.19,;38.38,-28.96,;37.04,-26.64,)|
CC(C)C[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccc(cc1)C(F)(F)F)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](Cc1c[nH]c2cc(F)ccc12)NC(=O)[C@@H](C)NC(=O)[C@H](N)[C@@H](C)O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCN=C(N)N)C(O)=O |r,wU:88.93,81.85,54.64,41.46,17.22,4.4,102.105,wD:86.90,66.81,49.50,26.38,8.13,94.97,(29.11,-49.65,;29.11,-48.11,;30.44,-47.34,;27.78,-47.34,;27.77,-45.8,;26.43,-45.03,;25.1,-45.8,;25.11,-47.34,;23.77,-45.03,;23.77,-43.49,;25.11,-42.71,;25.11,-41.17,;26.44,-40.41,;26.43,-38.84,;22.44,-45.8,;21.1,-45.03,;21.1,-43.49,;19.77,-45.8,;19.77,-47.34,;21.1,-48.1,;21.1,-49.64,;19.77,-50.42,;22.44,-50.42,;18.43,-45.03,;17.09,-45.8,;17.09,-47.34,;15.76,-45.03,;15.76,-43.49,;17.09,-42.72,;17.09,-41.18,;18.43,-40.41,;19.76,-41.17,;19.76,-42.71,;18.43,-43.49,;21.09,-40.39,;22.43,-41.16,;21.09,-38.85,;22.42,-39.61,;14.43,-45.8,;13.09,-45.03,;13.1,-43.49,;11.75,-45.8,;11.76,-47.34,;13.1,-48.11,;14.43,-47.34,;13.1,-49.65,;10.42,-45.03,;9.09,-45.8,;9.09,-47.35,;7.75,-45.03,;7.75,-43.49,;6.42,-45.8,;5.09,-45.03,;5.09,-43.49,;3.75,-45.81,;3.75,-47.34,;5.09,-48.11,;6.42,-47.34,;7.75,-48.12,;7.75,-49.66,;9.09,-50.42,;6.42,-50.42,;5.09,-49.66,;2.41,-45.03,;1.08,-45.8,;1.08,-47.34,;-.25,-45.03,;-.25,-43.49,;1.09,-42.72,;2.49,-43.35,;3.52,-42.2,;2.74,-40.86,;3.22,-39.39,;2.19,-38.25,;2.67,-36.78,;.68,-38.58,;.21,-40.04,;1.24,-41.19,;-1.59,-45.8,;-2.92,-45.03,;-2.92,-43.5,;-4.26,-45.81,;-4.25,-47.35,;-5.58,-45.03,;-6.92,-45.81,;-6.92,-47.35,;-8.26,-45.03,;-9.59,-45.81,;-8.26,-43.49,;-9.59,-42.73,;-6.93,-42.73,;29.1,-45.03,;29.1,-43.49,;30.44,-45.8,;31.77,-45.03,;31.77,-43.49,;33.11,-42.7,;33.11,-41.16,;34.44,-43.47,;33.11,-45.8,;33.11,-47.34,;34.45,-45.02,;35.78,-45.79,;35.78,-47.34,;37.11,-48.1,;37.11,-49.63,;38.45,-50.42,;38.45,-51.95,;37.12,-52.73,;39.79,-52.73,;37.12,-45.03,;38.45,-45.8,;37.11,-43.49,)|
CC(C)C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H]1CCCN1C(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](N)CC(O)=O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCN=C(N)N)C(O)=O |r,wU:38.43,22.30,8.8,90.95,wD:81.87,67.83,53.67,46.46,33.34,13.18,4.4,98.103,(32.98,-24.45,;32.95,-26.01,;34.25,-26.8,;31.61,-26.75,;31.58,-28.3,;30.23,-29.05,;28.92,-28.27,;28.95,-26.71,;27.56,-29.01,;27.53,-30.54,;26.25,-28.23,;24.9,-28.98,;24.86,-30.5,;23.59,-28.19,;23.62,-26.64,;24.96,-25.91,;24.98,-24.35,;23.65,-23.55,;26.31,-23.61,;22.23,-28.94,;20.92,-28.16,;20.96,-26.6,;19.57,-28.9,;19.53,-30.43,;20.86,-31.24,;22.22,-30.47,;23.54,-31.25,;23.52,-32.79,;22.17,-33.55,;20.85,-32.75,;18.26,-28.12,;16.9,-28.87,;16.87,-30.39,;15.59,-28.08,;15.63,-26.53,;14.24,-28.83,;12.93,-28.05,;12.96,-26.49,;11.57,-28.79,;11.55,-30.32,;12.87,-31.13,;12.84,-32.64,;14.23,-30.37,;10.26,-28,;8.91,-28.74,;8.88,-30.28,;7.6,-27.95,;7.7,-26.41,;6.06,-26.05,;5.21,-27.5,;6.32,-28.76,;6.1,-30.28,;7.31,-31.24,;4.68,-30.86,;3.47,-29.91,;2.04,-30.48,;.73,-29.66,;-.45,-30.64,;.12,-32.07,;-.56,-33.45,;.3,-34.73,;1.84,-34.63,;2.51,-33.24,;1.66,-31.97,;4.46,-32.38,;5.67,-33.33,;7.09,-32.76,;5.45,-34.86,;4.02,-35.43,;3.8,-36.95,;4.9,-38.02,;4.22,-39.4,;2.7,-39.18,;1.51,-40.17,;.07,-39.64,;-.19,-38.12,;.99,-37.14,;2.44,-37.67,;6.66,-35.81,;8.08,-35.24,;8.3,-33.71,;9.29,-36.19,;10.72,-35.61,;9.07,-37.71,;7.65,-38.28,;6.44,-37.33,;7.43,-39.81,;32.89,-29.09,;32.86,-30.61,;34.25,-28.34,;35.56,-29.12,;35.52,-30.65,;36.85,-31.45,;36.83,-32.97,;38.21,-30.7,;36.91,-28.38,;36.94,-26.82,;38.22,-29.16,;39.58,-28.41,;39.61,-26.86,;40.95,-26.12,;40.97,-24.56,;42.31,-23.83,;42.34,-22.28,;41.01,-21.47,;43.67,-21.54,;40.89,-29.2,;42.24,-28.45,;40.85,-30.72,)|
CC1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)C1 |r,t:1,4|
CCC1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)C1 |r,t:2,5|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)C1 |r,t:3,6|
CCCC1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)C1 |r,t:3,6|
Clc1ccc(cc1)[C@@H]1N=C2SC(C(=O)N3CCNC(=O)C3)=C(C3CC3)N2[C@@H]1c1ccc(Cl)cc1 |r,t:9,22|
CC(C)(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)C1 |r,t:4,7|
COCC1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)C1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCN(CC1)C(C)=O |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCC(CC1)C(=O)N(C)C |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCOCC1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCNC(=O)CC1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCN(CCO)CC1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CCN(C)CC1 |r,t:3,6|
CC(C)C1=C(SC2=N[C@H]([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1C[C@H](C)N[C@H](C)C1 |r,t:3,6|
CC[C@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(=O)OC(C)(C)C |r|
COc1ccc(C2=NC(C(N2C(=O)N2CCN(CC2)C(=O)CCCNC(=O)CCCC(=O)N(CC#N)S(=O)(=O)c2ccccc2)c2ccc(Cl)cc2)c2ccc(Cl)cc2)c(OC(C)C)c1 |t:6|
OC(=O)c1[nH]c2cc(Cl)ccc2c1[C@H]1N(Cc2cc(F)c(F)c(F)c2)C(=O)CCCCCCCCCCCCCCNC1=O |r|
CC1CCCCCCC(=O)N(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C(c2c([nH]c3cc(Cl)ccc23)C(O)=O)C(=O)N1
COc1cccc(CN2C(c3c([nH]c4cc(Cl)ccc34)C(O)=O)C(=O)NCCCCCCCCCCCCCC2=O)c1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C(=O)CCCCCCCCC\C=C/CCCCCCCCNC1=O |c:47|
OC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2cc(F)c(F)c(F)c2)C(=O)CCCCCCCCCCCCCCNC1=O
CC1CCCCCCCCCCCCC(=O)N(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C(c2c([nH]c3cc(Cl)ccc23)C(O)=O)C(=O)N1
OC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2ccc(Cl)cc2Cl)C(=O)CCCCCCCCCCCCCNC1=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2ccc(Cl)c(Cl)c2)C(=O)CCCCCCCCCCCCCNC1=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C(=O)CCCCCCCCCCCCCCCCCCCNC1=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2cc(F)c(F)c(F)c2)C(=O)CCCC\C=C\CCCCCCCCNC1=O |t:34|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C1N(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C(=O)CCCCCCC(C)NC1=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1[C@@H]1N(Cc2cc(F)c(F)c(F)c2)C(=O)CCCCCCCCCCCCCCNC1=O |r|
COc1ccc(CN2C(c3c([nH]c4cc(Cl)ccc34)C(O)=O)C(=O)NCCCCCCCCCCCCCC2=O)cc1
CC1CCCCCCCC(=O)N(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C(c2c([nH]c3cc(Cl)ccc23)C(O)=O)C(=O)N1
CC(C)(C)NC(=O)[C@H](N(Cc1ccc(OCc2ccc(Cl)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O |r|
COc1ccc(CNC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)c2cccc(NC(N)=N)c2)cc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)Nc1ccccc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCc1cccc(c1)-c1ccccc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCCc1ccc2ccccc2c1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCCc1ccccc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCc1ccc(Cl)cc1 |r|
C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)c1cccc(NC(N)=N)c1)c1ccccc1 |r|
C[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)c1cccc(NC(N)=N)c1)c1ccccc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)Nc1cccc2ccccc12 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NC(c1ccccc1)c1ccccc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCc1ccccc1 |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@](C)(CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O |r,c:59|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCCc1c[nH]c2ccccc12 |r|
NC(=N)Nc1cccc(c1)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCc1ccc(cc1)-c1ccccc1 |r|
COC(=O)C(N1C(c2ccc(Cl)cc2)C(SC)=Nc2cc(Cl)ccc2C1=O)c1ccc(Cl)cc1 |c:17|
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2c(Cl)cccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2ccc(Cl)cc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(F)ccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(F)c(F)cc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(F)cc2)C(=S)Nc2cc(Cl)ccc2C1=O)c1ccc(F)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2ccc(Cl)cc2C1=O)c1ccc(F)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2c(OC)cccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(ccc2C1=O)C(F)(F)F)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(ccc2C1=O)C(F)(F)F)c1ccc(F)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(OC)ccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2c(C)cccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2ccc(C)cc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2ccc(F)cc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(F)ccc2C1=O)c1ccc(F)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(Br)ccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(cc2)C(F)(F)F)C(=S)Nc2cc(Cl)ccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(OC)cc2)C(=S)Nc2cc(Cl)ccc2C1=O)c1ccc(Cl)cc1
CCOC(=O)CSC1=Nc2cc(OC)ccc2C(=O)N(C(C(=O)OC)c2ccc(Cl)cc2)C1c1ccc(Cl)cc1 |t:7|
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(NCc3ccc(cc3)C(F)(F)F)ccc2C1=O)c1ccc(Cl)cc1
COC(=O)C(N1C(c2ccc(Cl)cc2)C(=S)Nc2cc(Cl)ccc2C1=O)c1ccc(Cl)cc1
OC(=O)C[C@@H]1O[C@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CCC[C@@H](N1[C@@H]([C@@H](O[C@@H](Cc2ccc(F)cc2)C1=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(O)=O |r|
c1cc(cc(c1)Cl)[C@H]2C[C@@H](C(=O)N([C@@H]2c3ccc(cc3)Cl)CC4CC4)CC(=O)O
OC(=O)C[C@@H]1C[C@@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)C[C@@H]1O[C@@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)C[C@H]1O[C@@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)C[C@@H]1C[C@H]([C@@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)C[C@H]1C[C@H]([C@@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)C[C@@H]1C[C@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)C[C@H]1O[C@@H]([C@@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OC(=O)CC[C@@H]1O[C@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CNCC[C@@H]1O[C@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
OCC[C@@H]1O[C@H]([C@H](N(CC2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
Clc1ccc(cc1)[C@@H]1[C@@H](O[C@@H](CC=C)C(=O)N1CC1CC1)c1cccc(Cl)c1 |r|
CN1[C@@H]([C@@H](OCC1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
Clc1ccc(cc1)[C@@H]1[C@@H](OCC(=O)N1CC1CC1)c1cccc(Cl)c1 |r|
CN1[C@@H]([C@@H](OCC1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
COc1cccc2O[C@@H](C3=C(N(C)c4ncnn4[C@H]3c3ccc(Br)cc3)c12)c1ccc(Br)cc1 |r,t:9|
CC[C@@H](CO)N1[C@@H]([C@@H](O[C@H](C1=O)CC(=O)O)c2cccc(c2)Cl)c3ccc(cc3)Cl
COc1cccc(C[C@@H]2O[C@H]([C@H](N(C)C2=O)c2ccc(Br)cc2)c2ccc(Br)cc2)c1 |r|
COc1ccc(C[C@@H]2O[C@H]([C@H](N(C)C2=O)c2ccc(Br)cc2)c2ccc(Br)cc2)cc1 |r|
CN1[C@@H]([C@@H](O[C@@H](Cc2ccc(F)cc2)C1=O)c1ccc(Br)cc1)c1ccc(Br)cc1 |r|
CN1[C@@H]([C@@H](O[C@@H](Cc2ccc(Br)cc2)C1=O)c1ccc(Br)cc1)c1ccc(Br)cc1 |r|
CN1[C@H]([C@H](O[C@H](Cc2ccccc2)C1=O)c1ccc(Br)cc1)c1ccc(Br)cc1 |r|
CN1[C@@H]([C@@H](O[C@H](C1=O)Cc2ccccc2)c3ccc(cc3)Br)c4ccc(cc4)Br
CN1[C@@H]([C@@H](O[C@H](C1=O)Cc2ccccc2)c3ccc(cc3)Cl)c4ccc(cc4)Cl
CN1C[C@H](Cc2ccccc2)O[C@H]([C@H]1c1ccc(Br)cc1)c1ccc(Br)cc1 |r|
CN1[C@@H]([C@@H](OCC1=O)c1ccc(Br)cc1)c1ccc(Br)cc1 |r|
CC(C)N[C@@H]1CC[C@@H]([C@@H](C1)c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r|
CC(C)(C)OC(=O)N1CC(=O)N[C@@H]([C@@H]1c1ccc(Br)cc1)c1ccc(Br)cc1 |r|
COc1ccc(cc1OC)[C@H]1CC(=O)C=C([C@@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1 |r,c:15|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCCCN=C(N)N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@](C)(CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O |r,wU:138.147,123.132,110.114,148.153,34.36,8.8,63.78,79.81,50.52,wD:132.138,114.123,99.110,50.98,42.44,20.20,4.3,68.70,88.90,63.65,c:60,(47.02,-30.4,;47.02,-28.86,;48.37,-28.09,;45.69,-28.09,;45.69,-26.55,;44.35,-25.77,;43.01,-26.55,;43.01,-28.09,;41.68,-25.77,;41.68,-24.23,;43.01,-23.46,;44.34,-24.23,;45.68,-23.46,;45.68,-21.92,;47.01,-21.15,;47.01,-19.61,;48.35,-21.92,;40.33,-26.55,;39,-25.77,;39,-24.23,;37.66,-26.55,;37.66,-28.09,;39,-28.86,;40.41,-28.24,;41.44,-29.39,;40.67,-30.73,;41.14,-32.2,;40.1,-33.35,;38.6,-33.02,;38.12,-31.55,;39.15,-30.41,;36.32,-25.77,;34.98,-26.55,;34.98,-28.09,;33.64,-25.77,;33.64,-24.23,;34.98,-23.45,;34.98,-21.91,;36.32,-24.23,;32.31,-26.55,;30.96,-25.77,;30.96,-24.23,;29.63,-26.55,;29.63,-28.09,;30.96,-28.86,;32.31,-28.09,;30.96,-30.4,;28.29,-25.77,;26.96,-26.55,;26.96,-28.09,;25.61,-25.77,;24.27,-25,;25.61,-24.23,;26.94,-23.46,;26.94,-21.92,;28.27,-21.14,;28.27,-19.6,;29.6,-18.83,;29.6,-17.29,;30.93,-16.52,;48.34,-18.84,;49.68,-19.61,;49.69,-21.15,;51.02,-21.91,;52.35,-22.68,;51.03,-23.45,;49.7,-24.23,;48.36,-23.46,;49.7,-25.77,;51.04,-26.53,;51.04,-28.07,;52.38,-28.84,;49.71,-28.85,;48.37,-26.55,;47.02,-25.77,;47.02,-24.23,;52.35,-21.14,;53.69,-21.9,;52.35,-19.6,;53.68,-18.82,;53.67,-17.28,;55,-16.51,;55,-14.97,;53.66,-14.2,;56.33,-14.2,;55.02,-19.59,;55.02,-21.13,;56.35,-18.81,;57.68,-19.58,;57.69,-21.12,;59.02,-21.89,;60.36,-21.11,;59.03,-23.43,;59.01,-18.81,;60.35,-19.57,;59.01,-17.27,;24.28,-26.55,;22.94,-25.77,;22.94,-24.23,;21.6,-26.55,;21.6,-28.09,;22.94,-28.86,;24.27,-28.09,;25.62,-28.87,;25.61,-30.41,;24.28,-31.18,;22.94,-30.41,;20.27,-25.77,;18.92,-26.55,;18.92,-28.09,;17.59,-25.77,;16.25,-26.55,;14.91,-25.77,;14.91,-24.23,;13.58,-26.55,;13.58,-28.09,;14.91,-28.86,;14.91,-30.4,;13.58,-31.18,;16.25,-31.18,;12.23,-25.77,;10.9,-26.55,;10.9,-28.09,;9.56,-25.77,;9.56,-24.23,;10.9,-23.45,;10.9,-21.91,;9.56,-21.13,;12.23,-21.13,;8.23,-26.55,;6.88,-25.77,;6.88,-24.23,;5.55,-26.55,;5.55,-28.09,;6.88,-28.86,;4.21,-25.77,;2.86,-26.55,;2.86,-28.09,;1.53,-25.77,;1.53,-24.23,;2.86,-23.45,;2.86,-21.91,;1.53,-21.13,;4.21,-21.13,;.19,-26.55,;-1.16,-25.78,;-2.49,-26.56,;-1.15,-24.24,;17.59,-24.23,;16.25,-23.45,;18.92,-23.45,)|
COc1ccc(C2=NC(C(N2C(=O)N2CCN(CC2)C(C)=O)c2ccc(Cl)cc2)c2ccc(Cl)cc2)c(OC(C)C)c1 |t:6|
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(CP([O-])([O-])=O)cc1)C(=O)N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)C(=O)N[C@@H](CCC(O)=O)C(=O)NC1(CC1)C(=O)N[C@@H](CC(C)C)C(N)=O
CSCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(N)=O |r|
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCSC)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(N)=O |r,wU:19.27,4.4,57.58,83.87,96.100,wD:37.43,30.30,8.16,49.50,69.71,104.108,(23.12,1.98,;21.78,1.21,;21.78,-.34,;20.45,-1.11,;20.45,-2.65,;19.12,-3.42,;17.79,-2.65,;17.79,-1.11,;16.45,-3.42,;16.45,-4.96,;17.79,-5.73,;19.12,-4.96,;20.45,-5.73,;20.45,-7.27,;19.11,-8.05,;17.79,-7.28,;15.11,-2.65,;13.79,-3.42,;13.79,-4.96,;12.45,-2.65,;12.45,-1.11,;13.79,-.34,;13.79,1.21,;15.11,1.98,;15.11,3.52,;13.79,4.29,;16.45,4.29,;11.11,-3.42,;9.78,-2.65,;9.78,-1.11,;8.45,-3.42,;8.29,-4.95,;6.78,-5.28,;6.01,-3.94,;7.04,-2.8,;6.72,-1.29,;7.81,-.2,;5.23,-.89,;4.14,-1.98,;4.54,-3.47,;3.45,-4.56,;3.85,-6.04,;4.83,.6,;5.92,1.7,;7.41,1.3,;5.53,3.17,;21.78,-3.42,;21.78,-4.96,;23.12,-2.65,;24.45,-3.42,;24.45,-4.96,;25.79,-5.73,;27.12,-4.96,;25.79,-7.27,;25.79,-2.65,;25.79,-1.11,;27.12,-3.42,;28.45,-2.65,;28.45,-1.11,;29.78,-.34,;31.13,-1.12,;32.46,-.35,;32.46,1.2,;33.79,1.97,;31.12,1.97,;29.78,1.21,;29.78,-3.42,;29.78,-4.96,;31.12,-2.65,;32.45,-3.42,;32.45,-4.96,;33.74,-5.8,;35.18,-5.25,;36.15,-6.44,;35.31,-7.73,;35.72,-9.22,;34.63,-10.31,;33.15,-9.92,;32.74,-8.42,;33.83,-7.34,;33.79,-2.65,;33.79,-1.11,;35.12,-3.42,;36.46,-2.65,;36.46,-1.11,;37.78,-.34,;37.78,1.21,;36.46,1.98,;39.12,1.98,;37.78,-3.42,;37.78,-4.96,;39.12,-2.65,;40.46,-3.42,;41.79,-2.65,;41.79,-1.11,;43.12,-3.42,;44.46,-2.65,;44.46,-1.11,;45.79,-.34,;45.79,1.21,;47.12,-1.11,;45.79,-3.42,;45.79,-4.96,;47.12,-2.65,;48.46,-3.42,;48.46,-4.96,;49.79,-5.73,;51.12,-4.96,;49.79,-7.27,;49.79,-2.65,;51.12,-3.42,;49.79,-1.11,)|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCNC(=O)C1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@](C)([C@H](N1C(=O)N1CCN(CCCS(C)(=O)=O)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](CC)(c2ccc(Cl)cc2)[C@](CC)(N1C(=O)N1CCN(CCCS(C)(=O)=O)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CC(=O)N2CCOCC2)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CC(=O)N2CCCC2)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CCNC(C)=O)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CCNS(C)(=O)=O)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C2=N[C@@]([C@@](N2C(=O)N3CCN(CC3)CCCS(=O)(=O)C)(C)c4ccc(cc4)Cl)(C)c5ccc(cc5)Cl)C(C)(C)C
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CCO)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CCC(F)(F)F)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCN(CC1)C(C)=O)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCCCC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](C)(N1C(=O)N1CCNCC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
Clc1ccc2n(C(Cc3ccccc3)C(=O)NC3CCCCC3)c(=O)[nH]c2c1
Clc1ccc2n(C(Cc3ccccc3)C(=O)NCCc3ccccc3)c(=O)[nH]c2c1
Clc1ccc2n(C(C(=O)NC3CCCCC3)c3ccc(Br)cc3)c(=O)[nH]c2c1
CC(C)(C)NC(=O)C(Cc1ccccc1)n1c2ccc(Cl)cc2[nH]c1=O
FC(F)(F)c1ccc(cc1)C(C(=O)NC1CCCCC1)n1c2ccc(Cl)cc2[nH]c1=O
Clc1ccc2n(C(Cc3ccccc3)C(=O)NCc3ccccc3)c(=O)[nH]c2c1
CC(C)(C)NC(=O)C(c1c2ccc(cc2[nH]c1C(=O)O)Cl)N(Cc3ccc(c(c3)F)F)C=O
OC(=O)[C@H](N1[C@@H](c2ccc(Cl)cc2)C(=O)Nc2ccc(I)cc2C1=O)c1ccc(Cl)cc1 |r|
CC(C)(C)C[C@@H]1[C@]2(c3ccc(cc3NC2=O)Cl)[C@@H]([C@@H](N1)C(=O)NCCN4CCOCC4)c5cccc(c5F)Cl
[H][C@]12CCCN1C(=O)[C@@H](CCC(O)=O)NC(=O)[C@]([H])(NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@]1([H])CSSC[C@@]([H])(NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@]([H])(CSSC[C@@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(N)=O)NC(=O)[C@H](N)CC3=CN=CN3)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CC3=CNC4=C3C=CC=C4)C(=O)N[C@H](CC3=CC=C(O)C=C3)C(=O)N1)NC(=O)[C@@H](CCCCN)NC(=O)[C@@H](C)NC2=O)C(O)=O)[C@H](C)O |r,c:27,29,94,117,120,122,135,t:25,92,114,130,132|
[H][C@]12CCCN1C(=O)[C@@H](C)NC(=O)[C@@H](CCCCN)NC(=O)[C@H]1CSSC[C@@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](CC3=CNC4=C3C=CC=C4)NC(=O)[C@@H](CC3=CC=C(O)C=C3)NC(=O)[C@@]([H])(CSSC[C@@H](N)C(=O)N[C@H](CC(N)=O)C(=O)N1)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@]([H])(NC(=O)[C@@H](CCC(O)=O)NC2=O)[C@H](C)O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](CC1=CN=CN1)C(O)=O |r,c:48,51,53,66,107,109,157,t:45,61,63,105,155|
[H][C@@]12CCCN1C(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC3=CNC4=C3C=CC=C4)NC(=O)[C@H](CC3=CC=C(O)C=C3)NC(=O)[C@]([H])(CSSC[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@]([H])(NC(=O)[C@H](CCC(O)=O)NC2=O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC1=CN=CN1)C(O)=O |r,c:49,52,54,67,108,110,158,t:46,62,64,106,156|
COc1ccc(COC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)OCc2ccccc2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)OC2CCCCCC2)C(=O)N[C@@H](C)C(=O)NN)cc1 |r|
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CSSc1ncccc1[N+]([O-])=O)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CCC[NH+]=C([NH-])NS(=O)(=O)c1c(C)cc(C)cc1C)C(=O)OC |r,w:47.48|
COc1ccc(COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(C)=O)C(=O)N[C@@H](Cc2cn(c3ccccc23)S(=O)(=O)c2c(C)cc(C)cc2C)C(=O)N[C@@H](CC(C)C)C(=O)NN)cc1 |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@H](C1)NS(C)(=O)=O |r,wU:17.19,8.8,31.34,5.4,wD:7.31,33.39,(12.69,-41.86,;11.49,-40.9,;11.72,-39.38,;12.96,-40.5,;10.05,-41.46,;8.85,-40.49,;8.93,-38.96,;7.48,-38.41,;6.52,-39.61,;5.18,-38.84,;3.85,-39.62,;2.51,-38.85,;2.5,-37.3,;3.84,-36.52,;3.84,-34.98,;5.18,-37.29,;5.17,-35.74,;7.37,-40.9,;8.28,-42.16,;9.82,-42.16,;7.36,-43.41,;5.89,-42.93,;4.56,-43.71,;3.22,-42.93,;1.89,-43.7,;3.22,-41.39,;4.55,-40.62,;5.89,-41.38,;7.49,-36.87,;6.16,-36.1,;8.83,-36.11,;10.16,-36.88,;11.64,-36.5,;12.03,-37.98,;10.54,-38.38,;13.36,-38.76,;14.7,-37.99,;14.71,-36.45,;16.24,-37.99,;15.47,-39.33,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:33.38,17.19,8.8,31.34,5.4,wD:33.37,7.31,(42.41,-31.09,;41.21,-30.13,;41.45,-28.61,;42.69,-29.73,;39.78,-30.69,;38.58,-29.72,;38.65,-28.19,;37.21,-27.64,;36.25,-28.84,;34.91,-28.07,;33.58,-28.84,;32.23,-28.08,;32.23,-26.52,;33.57,-25.75,;33.56,-24.21,;34.91,-26.52,;34.9,-24.97,;37.09,-30.13,;38,-31.39,;39.54,-31.39,;37.09,-32.64,;35.61,-32.16,;34.28,-32.93,;32.95,-32.16,;31.61,-32.93,;32.95,-30.62,;34.28,-29.85,;35.61,-30.61,;37.21,-26.1,;35.88,-25.33,;38.55,-25.33,;40.09,-25.32,;41.18,-24.24,;42.26,-25.32,;43.59,-24.55,;43.6,-26.09,;41.19,-26.42,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@](C)(O)C1 |r,wU:33.37,17.19,8.8,31.34,5.4,wD:33.38,7.31,(28.66,-31.03,;27.45,-30.07,;27.69,-28.55,;28.93,-29.66,;26.02,-30.63,;24.82,-29.66,;24.89,-28.12,;23.45,-27.58,;22.49,-28.78,;21.15,-28.01,;19.82,-28.78,;18.48,-28.02,;18.47,-26.46,;19.81,-25.69,;19.81,-24.15,;21.15,-26.46,;21.14,-24.91,;23.33,-30.07,;24.24,-31.33,;25.78,-31.33,;23.33,-32.58,;21.86,-32.1,;20.52,-32.87,;19.19,-32.1,;17.86,-32.87,;19.19,-30.56,;20.52,-29.79,;21.86,-30.55,;23.46,-26.04,;22.13,-25.26,;24.79,-25.27,;26.33,-25.26,;27.42,-24.18,;28.5,-25.26,;29.83,-24.48,;29.84,-26.02,;27.43,-26.36,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC(C)(C)O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)C1 |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@@H](O)C1 |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@@H]1C[C@H](O)C1 |r,wU:17.19,8.8,31.34,5.4,33.37,wD:7.31,(13.04,-18.98,;11.84,-18.02,;12.07,-16.5,;13.31,-17.62,;10.4,-18.58,;9.2,-17.61,;9.28,-16.08,;7.83,-15.53,;6.87,-16.73,;5.53,-15.96,;4.2,-16.73,;2.86,-15.97,;2.85,-14.41,;4.19,-13.64,;4.19,-12.1,;5.53,-14.41,;5.52,-12.86,;7.72,-18.02,;8.63,-19.28,;10.17,-19.28,;7.71,-20.53,;6.24,-20.05,;4.91,-20.82,;3.57,-20.05,;2.24,-20.82,;3.57,-18.51,;4.9,-17.74,;6.24,-18.5,;7.84,-13.99,;6.51,-13.22,;9.18,-13.22,;10.51,-14,;10.89,-15.5,;12.38,-15.1,;13.71,-15.88,;11.99,-13.62,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@H](O)C1 |r,wU:17.19,8.8,31.34,5.4,wD:7.31,33.37,(42.17,-8.02,;40.97,-7.05,;41.2,-5.53,;42.45,-6.65,;39.53,-7.61,;38.33,-6.65,;38.41,-5.11,;36.97,-4.56,;36.01,-5.76,;34.66,-4.99,;33.33,-5.77,;31.99,-5.01,;31.98,-3.45,;33.32,-2.67,;33.32,-1.13,;34.66,-3.44,;34.66,-1.9,;36.85,-7.05,;37.76,-8.31,;39.3,-8.31,;36.85,-9.57,;35.37,-9.09,;34.04,-9.86,;32.71,-9.09,;31.37,-9.86,;32.71,-7.54,;34.04,-6.77,;35.37,-7.54,;36.97,-3.02,;35.64,-2.25,;38.31,-2.26,;39.64,-3.03,;41.12,-2.65,;41.52,-4.14,;42.85,-4.91,;40.03,-4.53,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCC[C@H](O)CO |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1F)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1ccc(C(O)=O)c(F)c1 |r|
COc1cc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@](C#N)([C@H]2c2cccc(Cl)c2F)c2ccc(Cl)cc2F)ccc1C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1ccc2cc(ccc2c1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cn1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1cccc(c1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(C#N)c1ccc(Cl)cc1F)C(=O)Nc1ccn(CC(C)(C)O)n1 |r|
CC(C)(C)C[C@H]1[C@]([C@H]([C@@H](N1)C(=O)NCC[C@@H](CO)O)c2cccc(c2F)Cl)(C#N)c3ccc(cc3F)Cl
CC(C)(C)C[C@H]1[C@]([C@H]([C@@H](N1)C(=O)NCC[C@@H](CO)O)c2cccc(c2)Cl)(C#N)c3ccc(cc3)Cl
FC(F)(F)c1cccc2cc3c(nc(=O)[nH]c3=O)n(Cc3ccccc3)c12
Cc1ccc(cc1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(c12)C(F)(F)F
Cc1cccc(c1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(c12)C(F)(F)F
Fc1ccc(cc1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(c12)C(F)(F)F
Fc1cccc(c1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(c12)C(F)(F)F
FC(F)(F)c1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccc(Cl)c(Cl)c3)c12
FC(F)(F)c1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3cccc(Cl)c3)c12
FC(F)(F)c1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccc(Cl)cc3)c12
FC(F)(F)c1ccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccc(Cl)cc3)c2c1
FC(F)(F)c1ccc2n(-c3ccc(Cl)cc3)c3nc(=O)[nH]c(=O)c3cc2c1
FC(F)(F)c1cccc2n(-c3ccc(Cl)cc3)c3nc(=O)[nH]c(=O)c3cc12
Fc1ccccc1-n1c2nc(=O)[nH]c(=O)c2cc2cccc(c12)C(F)(F)F |(-4.2,-.87,;-2.87,-1.65,;-2.87,-3.19,;-1.54,-3.96,;-.2,-3.18,;-.2,-1.65,;-1.53,-.89,;-1.53,.65,;-2.85,1.42,;-4.19,.65,;-5.51,1.42,;-6.85,.64,;-5.51,2.96,;-4.19,3.73,;-4.19,5.27,;-2.86,2.96,;-1.53,3.73,;-.2,2.96,;1.13,3.74,;2.47,2.96,;2.47,1.42,;1.14,.65,;-.19,1.42,;1.12,-.89,;1.11,-2.43,;-.42,-.88,;2.66,-.89,)|
Fc1ccccc1-n1c2cc(ccc2cc2c1nc(=O)[nH]c2=O)C(F)(F)F |(61.91,-22.27,;63.24,-23.04,;63.24,-24.58,;64.58,-25.34,;65.92,-24.56,;65.91,-23.03,;64.58,-22.27,;64.57,-20.73,;65.91,-19.95,;67.24,-20.72,;68.58,-19.95,;68.57,-18.4,;67.23,-17.64,;65.9,-18.41,;64.57,-17.65,;63.24,-18.41,;63.24,-19.96,;61.9,-20.73,;60.57,-19.97,;59.23,-20.74,;60.56,-18.41,;61.9,-17.64,;61.91,-16.1,;69.91,-20.71,;69.92,-22.25,;71.24,-19.94,;71.24,-21.47,)|
FC(F)(F)c1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12
[O-][N+](=O)c1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccc(Cl)cc3)c12
[O-][N+](=O)c1ccc2n(-c3ccc(Cl)cc3)c3nc(=O)[nH]c(=O)c3cc2c1
[O-][N+](=O)c1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3F)c12 |(4.4,-8.56,;5.84,-9.08,;7.03,-8.09,;6.11,-10.6,;4.78,-11.37,;4.78,-12.91,;6.11,-13.68,;7.44,-12.91,;8.78,-13.68,;10.11,-12.91,;10.11,-11.37,;11.44,-10.6,;12.78,-11.37,;14.11,-10.6,;12.78,-12.91,;11.44,-13.68,;11.44,-15.22,;8.78,-10.6,;8.83,-8.6,;7.52,-7.79,;7.56,-6.25,;8.92,-5.52,;10.23,-6.33,;10.18,-7.86,;11.5,-8.67,;7.44,-11.37,)|
Clc1ccc(cc1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(Br)c12
Brc1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12
Cc1ccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccc(Cl)cc3)c2c1
Fc1cccc(c1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(Cl)c12
Clc1cccc(c1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(Cl)c12
Clc1ccc(cc1)-n1c2nc(=O)[nH]c(=O)c2cc2cccc(Cl)c12
Clc1ccc(cc1)-n1c2cccc(Cl)c2cc2c1nc(=O)[nH]c2=O
Fc1ccccc1-n1c2ccc(Cl)cc2cc2c1nc(=O)[nH]c2=O |(27.54,-55.69,;28.87,-56.46,;28.87,-58,;30.21,-58.77,;31.55,-57.99,;31.54,-56.46,;30.2,-55.69,;30.2,-54.15,;31.53,-53.38,;32.87,-54.14,;34.2,-53.37,;34.2,-51.82,;35.52,-51.04,;32.86,-51.06,;31.53,-51.83,;30.2,-51.07,;28.87,-51.84,;28.87,-53.38,;27.53,-54.15,;26.19,-53.39,;24.86,-54.16,;26.19,-51.83,;27.53,-51.06,;27.54,-49.52,)|
Clc1cccc2cc3c(nc(=O)[nH]c3=O)n(-c3ccccc3)c12
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ccc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@H]1N[C@H](CC(C)(C)C)[C@@]2([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)sc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@H]1N[C@H](CC(C)(C)C)[C@@]2([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)sc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@H]1N[C@H](CC(C)(C)C)[C@@]2([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ncc21)C(N)=O |r|
CC(C)(C)C[C@H]1[C@]2(c3c(cc(s3)Cl)NC2=O)[C@H]([C@@H](N1)C(=O)Nc4ccc(cc4OC)C(=O)N)c5cccc(c5F)Cl
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)sc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ncc21)C(N)=O |r|
COc1cc(ccc1NC(=O)C1NC(CC(C)(C)C)C2(C1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)sc21)C(N)=O
COc1cc(ccc1NC(=O)C1NC(CC(C)(C)C)C2(C1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)sc21)C(O)=O
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1nc(Cl)ncc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1nc(Cl)ncc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)cnc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)cnc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1nc(Cl)ccc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1nc(Cl)ccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1ncccc21)C(O)=O |r|
COc1cc(ccc1NC(=O)C1NC(CC(C)(C)C)C2(C1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ncc21)C(N)=O
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1cc(Cl)ncc21)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1ccncc21)C(N)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@]2([C@H]1c1cccc(Cl)c1F)C(=O)Nc1ccncc21)C(O)=O |r|
CC[C@@H](CS(=O)(=O)c1ccccc1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C1COC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C1CCCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C1CCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)CC1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(=O)(=O)CC)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CCS(C)(=O)=O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CS(C)(=O)=O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(=O)(=O)N2CCC2)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CC[C@@H](CNS(C)(=O)=O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CNS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@]1(C[C@@H]([C@H](N(C1=O)[C@H](CS(=O)(=O)N2CCCC2)C3CC3)c4ccc(cc4)Cl)c5cccc(c5)Cl)CC(=O)O
CC[C@@H](CC(C)(C)C#N)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CN(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CC#N)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](C[C@H](C)O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](C[C@@H](C)O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CCC(C)(C)O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CC(C)(C)O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)O |r|
C[C@]1(CC(O)=O)C[C@@H]([C@H](N([C@H](CS(C)(=O)=O)C2CC2)C1=O)c1ccc(Cl)cc1)c1cccc(Cl)c1 |r|
CC(C)[C@@H](CS(C)(=O)=O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@H](CS(C)(=O)=O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)S(=O)(=O)C[C@H](C1CCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)S(=O)(=O)C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)S(=O)(=O)C[C@@H](N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)C(C)(C)C |r|
CC(C)S(=O)(=O)C[C@H](C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](C1CCC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
C[C@@H](CS(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)S(=O)(=O)C[C@H](CC(F)(F)F)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(C)S(=O)(=O)C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CN(C[C@H](C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)S(=O)(=O)C1CC1 |r|
CC(C)[C@@H](CN(C)S(=O)(=O)C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CNS(=O)(=O)C1CC1)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC[C@@H](CN(C)S(=O)(=O)C(C)(C)C)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCc1ccc(cc1)C(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCCCCC(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCCC(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCC(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCCCCC(=O)Nc1ccccc1N)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCCCC(=O)Nc1ccccc1N)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCCC(=O)Nc1ccccc1N)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCC(=O)Nc1ccccc1N)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CCCCC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)NCCCCCCC(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=N[C@H]([C@H](N1C(=O)N1CCN(CCCCCCC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
CCOc1cc(ccc1C1=N[C@@H]([C@@H](N1C(=O)N1CCN(CCCCCCC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
c1ccc(cc1)NC(=O)CCCCCCC(=O)NO
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCC(CC1)C(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCC(CC1)C(=O)Nc1ccc(\C=C\C(=O)NO)cc1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCC(CC1)Nc1ncc(cn1)C(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CC1)c1ncc(cn1)C(=O)NO)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(Cc2ccc(cc2)C(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CCCCCCCC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CCCCCCC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CCCCCC(=O)NO)CC1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |t:10|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](C)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](C)NC(=O)[C@H](N)CC(O)=O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(=O)N[C@H](C(C)C)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](CC(O)=O)C(=O)N[C@H](C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@@H](C)N)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(=O)N[C@H](C)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](CC(O)=O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@@H](NC(=O)[C@@H](C)NC(=O)C(C)(C)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](NC(=O)[C@H](N)CC(O)=O)[C@@H](C)O)C(=O)N[C@H](C(C)C)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](CC(O)=O)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(Br)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC1=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O |r,t:63|
CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)NC(C)(C)C(=O)N[C@@H](Cc1ccc(CP(O)(O)=O)cc1)C(=O)N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)C(=O)N[C@@H](CCC(O)=O)C(=O)NC1(CC1)C(=O)N[C@@H](CC(C)C)C(N)=O
CCOc1cc(ccc1C2=N[C@H]([C@H](N2C(=O)N3CCN(CC3)CCO)c4ccc(cc4)Br)c5ccc(cc5)Br)OC
CN1C(=O)C(Cc2ccc(Cl)cc2)=C(c2c[nH]c3cc(Cl)ccc23)[C@]1(O)Cc1ccc(Cl)cc1 |r,t:13|
c1cc(ccc1CC2=C([C@](OC2=O)(Cc3ccc(cc3)Cl)O)c4c[nH]c5c4ccc(c5)Cl)Cl
COc1ccccc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |r|
COc1ccncc1-c1nc2C(=O)N([C@H](c2n1C(C)C)c1ccc(Cl)cc1C)c1cc(Cl)ccc1C |r|
Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1 |r|
CC1(C)CCC2(CC1)N[C@H]([C@H](c1ccnc(Cl)c1F)[C@]21C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@@H]1CC[C@H](OC1)C(N)=O |r|
CCCCCCC(C(O)=O)C(=C)C(O)=O
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(=O)N1CC[C@H]1C(=O)N(C)C |r,t:3,6|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(-c2ccccc2)c2ccccc2n1Cc1ccc(Cl)cc1 |(7.15,-2.34,;6.52,-1.28,;4.98,-1.29,;4.2,.03,;4.8,1.11,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.23,2.7,;1.23,3.86,;-.3,3.74,;-1.27,4.93,;-2.79,4.69,;-3.34,3.25,;-2.37,2.05,;-.85,2.3,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;3.63,3.25,;4.92,2.41,;6.29,3.11,;7.58,2.28,;8.95,2.98,;9.03,4.52,;10.13,5.08,;7.74,5.35,;6.37,4.65,)|
Clc1ccc(Cn2c(-c3c[nH]c4cc(Cl)ccc34)c(-c3ccccc3)c3ccccc23)cc1 |(4.61,-3.43,;4.68,-2.2,;6.05,-1.5,;6.13,.04,;4.84,.87,;4.92,2.41,;3.63,3.25,;2.23,2.7,;1.76,1.24,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.23,3.86,;-.3,3.74,;-1.08,2.41,;-2.62,2.42,;-3.38,3.75,;-2.61,5.08,;-1.07,5.08,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;3.47,.17,;3.39,-1.36,)|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(-c2ccc(Cl)cc2)c2ccccc2n1Cc1ccc(Cl)cc1 |(7.15,-2.34,;6.52,-1.28,;4.98,-1.29,;4.2,.03,;4.8,1.11,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.23,2.7,;1.23,3.86,;-.3,3.74,;-1.27,4.93,;-2.79,4.69,;-3.34,3.25,;-4.56,3.06,;-2.37,2.05,;-.85,2.3,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;3.63,3.25,;4.92,2.41,;6.29,3.11,;7.58,2.28,;8.95,2.98,;9.03,4.52,;10.13,5.08,;7.74,5.35,;6.37,4.65,)|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(-c2ccc(F)cc2)c2ccccc2n1Cc1ccc(Cl)cc1 |(7.15,-2.34,;6.52,-1.28,;4.98,-1.29,;4.2,.03,;4.8,1.11,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.23,2.7,;1.23,3.86,;-.3,3.74,;-1.27,4.93,;-2.79,4.69,;-3.34,3.25,;-4.56,3.06,;-2.37,2.05,;-.85,2.3,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;3.63,3.25,;4.92,2.41,;6.29,3.11,;7.58,2.28,;8.95,2.98,;9.03,4.52,;10.13,5.08,;7.74,5.35,;6.37,4.65,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(-c2ccc(F)cc2)c2ccccc2n1Cc1ccc(Cl)cc1 |(4.8,1.11,;4.2,.03,;4.82,-1.03,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.23,2.7,;1.23,3.86,;-.3,3.74,;-1.27,4.93,;-2.79,4.69,;-3.34,3.25,;-4.56,3.06,;-2.37,2.05,;-.85,2.3,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;3.63,3.25,;4.92,2.41,;6.29,3.11,;7.58,2.28,;8.95,2.98,;9.03,4.52,;10.13,5.08,;7.74,5.35,;6.37,4.65,)|
Clc1ccc(Cn2c(-c3c([nH]c4cc(Cl)ccc34)C(=O)NCCN3CCOCC3)c(-c3ccccc3)c3ccccc23)cc1 |(10.13,5.08,;9.03,4.52,;8.95,2.98,;7.58,2.28,;6.29,3.11,;4.92,2.41,;3.63,3.25,;2.23,2.7,;1.76,1.24,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;4.2,.03,;4.8,1.11,;4.98,-1.29,;6.52,-1.28,;7.3,-2.61,;8.84,-2.59,;9.63,-3.92,;11.17,-3.9,;11.92,-2.56,;11.14,-1.23,;9.6,-1.25,;1.23,3.86,;-.3,3.74,;-1.27,4.93,;-2.79,4.69,;-3.34,3.25,;-2.37,2.05,;-.85,2.3,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;6.37,4.65,;7.74,5.35,)|
OC(=O)c1[nH]c2cc(Cl)ccc2c1-c1c(-c2ccccc2)c2ccccc2n1Cc1ccc(Cl)cc1 |(4.8,1.11,;4.2,.03,;4.82,-1.03,;2.66,.02,;1.76,-1.24,;.3,-.77,;-1.03,-1.55,;-2.38,-.77,;-3.45,-1.38,;-2.38,.77,;-1.03,1.55,;.3,.77,;1.76,1.24,;2.23,2.7,;1.23,3.86,;-.3,3.74,;-1.27,4.93,;-2.79,4.69,;-3.34,3.25,;-2.37,2.05,;-.85,2.3,;2.04,5.16,;1.61,6.64,;2.7,7.75,;4.19,7.37,;4.62,5.87,;3.53,4.78,;3.63,3.25,;4.92,2.41,;6.29,3.11,;7.58,2.28,;8.95,2.98,;9.03,4.52,;10.13,5.08,;7.74,5.35,;6.37,4.65,)|
CC(C)Oc1ccc(cc1)-c1cc(nn1-c1ccc(Oc2ccccc2)cc1)C(O)=O
CC(C)Oc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)C(C)C)C(O)=O
CC(C)Oc1ccc(cc1)C(=O)Nc1c(nn(c1-c1ccc(OC(C)C)cc1)-c1ccc(Oc2ccccc2)cc1)C(O)=O
CCOc1ccc(cc1)-c1c(NC(=O)c2ccc(OC(C)C)cc2)c(nn1-c1ccc(Oc2ccccc2)cc1)C(O)=O
CCOc1ccc(cc1)-c1c(NC(=O)c2ccccc2)c(nn1-c1ccc(Oc2ccccc2)cc1)C(O)=O
CC(C)c1ccc(cc1)-n1nc(cc1-c1ccc(OCc2ccccc2)cc1)C(O)=O
CCOc1ccc(cc1)-c1cc(nn1-c1ccc(Oc2ccccc2)cc1)C(O)=O
CCOc1ccc(cc1)-c1cc(nn1-c1ccccc1)C(O)=O
CC(C)Oc1ccc(cc1)C(=O)Nc1c(nn(c1-c1ccc(OCc2ccccc2)cc1)-c1ccc(cc1)C(C)C)C(O)=O
COC(=O)c1nn(c(c1NC(=O)c1ccc(OC(C)C)cc1)-c1ccc(OC(C)C)cc1)-c1ccc(Oc2ccccc2)cc1
CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O |(-4.44,-1.63,;-5.78,-.86,;-7.11,-1.63,;-5.78,.68,;-7.11,1.45,;-8.44,.68,;-7.11,2.99,;-8.44,3.76,;-5.78,3.76,;-5.78,5.3,;-4.44,6.07,;-4.44,2.99,;-3.11,3.76,;-3.11,5.3,;-1.77,2.99,;-1.77,1.45,;-.44,.68,;-3.11,.68,;-4.44,1.45,;-.44,3.76,;-.44,5.3,;-1.77,6.07,;.89,6.07,;2.23,5.3,;3.56,6.07,;3.56,7.61,;4.89,8.38,;2.23,8.38,;4.89,5.3,;6.23,6.07,;4.89,3.76,;6.23,2.99,;3.56,2.99,;3.56,1.45,;4.89,.68,;2.23,3.76,;.89,2.99,;.89,1.45,)|
CCOc1ccc(cc1)-c1c(NC(=O)c2ccc(OCC(C)C)cc2)c(nn1-c1ccc(Oc2ccccc2)cc1)C(O)=O
CC(C)Oc1ccc(cc1)-c1cc(nn1-c1ccccc1)C(O)=O
CC(C)COc1ccc(cc1)C(=O)Nc1c(nn(c1-c1ccc(OC(C)C)cc1)-c1ccc(Oc2ccccc2)cc1)C(O)=O
CC(C)Oc1ccc(cc1)C(=O)Nc1c(nn(c1-c1ccc(OCc2ccccc2)cc1)-c1ccc(Oc2ccccc2)cc1)C(O)=O
Cc1ccc(cc1)\N=c1/c2ccc(C)cc2n(C(=O)c2ccc(cc2)C(C)(C)C)c2c(O)c(O)c(O)cc12
CC(C)c1ccc2c(c1)n(C(=O)c1ccc(cc1)C(C)(C)C)c1c(O)c(O)c(O)cc1\c2=N\c1ccc(Oc2ccccc2)cc1
OC(=O)c1cc(-c2ccc(OCc3ccccc3)cc2)n(n1)-c1ccccc1
CC(C)COc1ccc(cc1)-c1cc(nn1-c1ccccc1)C(O)=O
OC(=O)c1cc(-c2ccccc2)n(n1)-c1ccccc1
CCOc1ccc(cc1)-c1c(NC(=O)c2ccc(cc2)C(C)(C)C)c(nn1-c1ccc(Oc2ccccc2)cc1)C(O)=O
Clc1ccc2c(NC(=O)[C@]22[C@H]([C@@H](NC22CCCCC2)C(=O)NCCCCCc2cccc3C(=O)N(Cc23)C2CCC(=O)NC2=O)c2ccccc2)c1 |r|
O=C(NCCCCCc1cccc2C(=O)N(Cc12)C1CCC(=O)NC1=O)[C@@H]1NC2(CCCCC2)[C@]2([C@H]1c1ccccc1)C(=O)Nc1ccccc21 |r|
Fc1c(Cl)cccc1[C@H]1[C@@H](NC2(CCCCC2)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCCCCc1cccc2C(=O)N(Cc12)C1CCC(=O)NC1=O |r|
Fc1ccccc1[C@H]1[C@@H](NC2(CCCCC2)[C@@]11C(=O)Nc2ccccc12)C(=O)NCCCCCc1cccc2C(=O)N(Cc12)C1CCC(=O)NC1=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC1CCCCC1)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(=O)(=O)CCCC\C=C\CCCCS1(=O)=O)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r,t:98|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(=O)(=O)CC\C=C\CCCCS1(=O)=O)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r,t:96|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(C)(=O)=O)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(=O)(=O)c1ccc(Cl)cc1)S(C)(=O)=O)Cc1ccccc1)S(C)(=O)=O)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@@H](C)CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(=O)(=O)CC(C)C)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(C)(=O)=O)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](CO)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(C)(=O)=O)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(N)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(C)(=O)=O)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC1CCC1)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NC(C)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(O)=O)CN(CC(=O)N[C@H](CN(CC(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)CN(CC(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)S(C)(=O)=O)Cc1c[nH]c2ccccc12)S(C)(=O)=O)S(C)(=O)=O)Cc1ccccc1)S(C)(=O)=O)NC(C)=O |r|
COc1cc2CC(=O)N([C@@H](c3ccccc3)c2cc1OC(C)C)c1ccc(cc1)N(C)C[C@H]1CC[C@@H](CC1)N1CCN(C)C(=O)C1 |r,wU:32.35,wD:9.9,35.42,(19.45,-7.98,;18.11,-7.22,;16.78,-7.99,;15.45,-7.23,;14.13,-8,;12.8,-7.22,;11.47,-8,;10.14,-7.23,;11.47,-9.54,;12.8,-10.3,;12.8,-11.83,;11.47,-12.61,;11.47,-14.14,;12.8,-14.91,;14.14,-14.13,;14.13,-12.6,;14.13,-9.53,;15.46,-10.3,;16.79,-9.53,;18.12,-10.3,;18.12,-11.84,;19.46,-12.61,;16.79,-12.61,;10.14,-10.31,;8.81,-9.54,;7.47,-10.31,;7.48,-11.85,;8.82,-12.62,;10.15,-11.84,;6.14,-12.62,;6.15,-14.16,;4.81,-11.86,;4.8,-10.32,;3.46,-9.55,;3.47,-8.01,;4.8,-7.24,;6.13,-8.01,;6.13,-9.55,;4.8,-5.69,;3.47,-4.93,;3.48,-3.38,;4.82,-2.62,;4.83,-1.08,;6.15,-3.39,;7.48,-2.63,;6.14,-4.93,)|
CC(C)(C)NC(=O)[C@@H](c1c2ccc(cc2[nH]c1C(=O)O)Cl)N(Cc3ccc(cc3)OCc4ccc(cc4)Cl)C=O
CC(C)[C@H](N1[C@@H]([C@@H](C[C@H](CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1)S(=O)(=O)C(C)C |r|
CC[C@H]([C@@H](C)O)N1[C@@H]([C@H](C[C@](C)(CC(O)=O)C1=O)c1cccc(Cl)c1)c1ccc(Cl)cc1 |r|
CC(C)(C)C[C@H]1NC([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1C[C@@](C)(O)C1 |r,wU:33.38,17.29,31.34,8.8,wD:5.4,(55.7,-19.72,;54.25,-19.21,;53.96,-17.7,;55.33,-18.11,;53.08,-20.22,;51.63,-19.71,;51.18,-18.23,;49.64,-18.2,;49.13,-19.66,;47.62,-19.35,;47.13,-17.89,;45.63,-17.58,;44.6,-18.74,;45.1,-20.2,;44.09,-21.36,;46.61,-20.5,;45.83,-21.82,;50.36,-20.59,;51.61,-21.5,;53.08,-21.03,;51.13,-22.97,;49.59,-22.97,;48.57,-24.1,;47.07,-23.79,;46.05,-24.94,;46.59,-22.32,;47.62,-21.19,;49.12,-21.51,;49.2,-16.72,;47.7,-16.36,;50.26,-15.6,;51.76,-15.96,;53.06,-15.15,;53.86,-16.46,;54.95,-15.36,;55.36,-16.85,;52.56,-17.27,)|
Fc1cccc(F)c1N[C@@]1(Cc2cccc(Cl)c2)C(=O)Nc2cc(Cl)ccc12 |r|
CC(C)C[C@H](N[C@H](C(=O)NCc1ccccc1)c1c([nH]c2cc(Cl)ccc12)C(=O)NO)C(=O)NO |r|
CC(C)(C)NC(=O)[C@H](c1c2ccc(cc2[nH]c1C(=O)O)Cl)N(Cc3ccc(cc3)Cl)C=O
CC(=O)N1C(=O)[C@@]2(S[C@H]([C@@H](O)C[C@@H]2c2ccccc2)C(=O)c2ccccc2)c2c1cccc2Br |r|
CC(C)(C)C[C@H]1NC([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:17.29,8.8,31.34,wD:5.4,34.38,(26.42,-21.67,;26.71,-23.19,;27.79,-22.08,;28.16,-23.69,;25.54,-24.19,;24.09,-23.68,;23.64,-22.2,;22.09,-22.17,;21.58,-23.63,;20.07,-23.32,;19.59,-21.85,;18.08,-21.55,;17.05,-22.71,;17.55,-24.18,;16.53,-25.33,;19.06,-24.48,;18.28,-25.8,;22.81,-24.57,;24.07,-25.48,;25.53,-25,;23.58,-26.94,;22.04,-26.94,;21.02,-28.08,;19.52,-27.77,;18.49,-28.92,;19.04,-26.31,;20.07,-25.16,;21.57,-25.48,;21.65,-20.69,;20.15,-20.33,;22.71,-19.57,;22.28,-18.1,;20.79,-17.74,;20.37,-16.26,;21.43,-15.16,;21,-13.68,;22.92,-15.53,;23.35,-16.99,)|
O[C@H]1C[C@H](c2ccccc2)[C@@]2(S[C@H]1C(=O)c1ccc(Br)cc1)C(=O)Nc1cccc(Br)c21 |r|
CC(C)C1=C(SC2=N[C@](C)([C@H](N12)c1ccc(Cl)c(F)c1)c1ccc(Cl)cc1)C(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC2(CC2)NC[C@@H]1C |r,t:3,6|
CC(=O)N(Cc1ccc(OCc2ccc(F)cc2)cc1)C(C(=O)NC1CCCCC1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(OCc2ccc(Br)cc2)cc1)C=O)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:39:40:37.38.43:44,THB:39:38:44:45.40.41,41:40:37:43.42.44,41:42:37:45.39.40|
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2cccc(F)c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2cccc(Br)c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1cc(F)c(OCc2ccccc2)c(F)c1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(cc2)C#N)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2cc(F)cc(F)c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2cccc(Cl)c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(Cl)cc2Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2c(Cl)cccc2Cl)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)[C@H](N(Cc1ccc(OCc2ccccc2Br)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O |r|
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(I)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2cccc(I)c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2I)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(cc2)-c2ccccc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
COc1cccc(COc2ccc(CN(C=O)C(C(=O)NC(C)(C)C)c3c([nH]c4cc(Cl)ccc34)C(O)=O)cc2)c1
COc1cccc(COc2ccc(CN(C=O)C(C(=O)NC(C)(C)C)c3c([nH]c4cc(Cl)ccc34)C(O)=O)cc2)c1OC
Cc1ccc(COc2ccc(CN(C=O)C(C(=O)NC(C)(C)C)c3c([nH]c4cc(Cl)ccc34)C(O)=O)cc2)cc1
CC(C)(C)NC(=O)C(N(Cc1ccc(OC2CCCC2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccncc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(CCc1ccc(OCc2ccc(Br)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(OCc2ccccc2Br)cc1)C=O)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:35:36:38:42.40.41,THB:40:39:36:42.41.43,40:41:36:38.39.45,43:41:38:36.45.44,43:44:38:42.40.41,(62.85,-14.7,;62.09,-13.36,;62.86,-12.03,;60.55,-13.36,;59.64,-14.6,;58.17,-14.12,;56.84,-14.9,;55.5,-14.12,;54.17,-14.89,;55.51,-12.58,;56.84,-11.81,;58.18,-12.58,;59.64,-12.11,;60.12,-10.64,;59.1,-9.5,;57.59,-9.81,;56.56,-8.66,;57.05,-7.2,;56.02,-6.06,;54.51,-6.37,;53.49,-5.23,;51.98,-5.55,;50.95,-4.4,;49.45,-4.72,;48.42,-3.58,;48.89,-2.11,;50.4,-1.79,;51.43,-2.94,;52.94,-2.62,;54.04,-7.85,;55.07,-8.99,;59.58,-8.03,;58.55,-6.88,;61.63,-10.33,;62.89,-11.2,;62.11,-8.86,;63.62,-8.55,;64.71,-9.56,;64.82,-11.31,;65.54,-9.92,;66.91,-9.28,;66.67,-7.66,;65.97,-8.92,;65.56,-6.61,;64.18,-7.24,;64.37,-8.84,)|
[H][C@]12CC[C@@](C)(C(C1)NC(=O)C(N(Cc1ccc(OCc3ccc(Br)cc3)cc1)C=O)c1c([nH]c3cc(Cl)ccc13)C(O)=O)C2(C)C |r,TLB:8:6:44:2.3|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(OCc2ccsc2)cc1)C=O)C(=O)NC(C)(C)C
CC(C)(C)NC(=O)C(N(Cc1ccc(NCc2ccc(Br)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2Br)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(=O)NCCN1CCOCC1
CC(C)(C)NC(=O)C(NCc1ccc(OCc2ccccc2Br)cc1)c1c([nH]c2cc(Cl)ccc12)C(O)=O
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(CCc1ccccc1)C=O)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:31:32:29.30.35:36,THB:31:30:36:37.32.33,33:32:29:35.34.36,33:34:29:37.31.32|
CC(C)(C)NC(=O)C(N(CCCN1CCOCC1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2Br)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCCc2ccccc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(=O)N(Cc1ccc(OCc2ccccc2)cc1)C(C(=O)NC12CC3CC(CC(C3)C1)C2)c1c([nH]c2cc(Cl)ccc12)C(O)=O |TLB:26:27:24.25.30:31,THB:26:25:31:32.27.28,28:27:24:30.29.31,28:29:24:32.26.27|
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2F)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)[C@@H](N(Cc1ccc(OCc2ccccc2Br)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O |r|
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccc2C(F)(F)F)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc3ccccc3c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCC2CCCCC2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccccn2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
[H][C@]12CC[C@@](C)(C(C1)NC(=O)C(N(Cc1ccc(OCc3ccccc3Br)cc1)C=O)c1c([nH]c3cc(Cl)ccc13)C(O)=O)C2(C)C |r,TLB:8:6:44:2.3|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1ccc(NCc2ccc(Br)cc2)cc1)C=O)C(=O)NC(C)(C)C
OC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(CCc1ccccc1)C=O)C(=O)NCCc1ccccc1
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(F)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)(C)NC(=O)C(N(Cc1ccc(OCc2ccc(Br)cc2)cc1)C=O)c1c([nH]c2cc(Cl)ccc12)C(O)=O
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)CC[C@@H]1NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)c1ccc(c(c1)C([O-])=O)-c1c2ccc(cc2oc2cc(ccc12)=[N+](C)C)N(C)C)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCN)C(N)=O |r|
CC(C)C[C@H](NC(=O)COCCOCCNC(=O)CC[C@@H]1NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)CC[C@@H]1NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H](Cc2ccccc2)NC1=O)C(N)=O |r|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CO)C(=O)NCCOCCOCC(=O)N[C@@H](CCCCNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(C)=O)C(N)=O |r|
Brc1ccc(cc1)[C@@H]1CC=C(S[C@@]11C(=O)Nc2ccccc12)C(=O)c1ccccc1 |r,c:10|
Brc1cccc2NC(=O)[C@@]3(SC(=CC[C@H]3c3ccccc3)C(=O)c3ccco3)c12 |r,c:11|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(O)=O
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccccc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)NCCN1CCOCC1 |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:17.29,5.4,31.34,8.8,wD:7.31,34.38,(46.22,-17.82,;44.89,-17.05,;44.89,-15.51,;46.22,-16.28,;43.55,-17.82,;42.22,-17.05,;42.22,-15.51,;40.73,-15.11,;39.89,-16.41,;38.56,-15.63,;37.23,-16.41,;35.9,-15.63,;35.9,-14.09,;37.22,-13.33,;37.22,-11.79,;38.56,-14.09,;39.89,-14.86,;40.87,-17.6,;41.77,-18.84,;43.31,-18.84,;40.87,-20.09,;39.39,-19.62,;38.07,-20.38,;36.74,-19.63,;35.41,-20.39,;36.74,-18.08,;38.07,-17.3,;39.39,-18.07,;40.34,-13.62,;38.85,-13.23,;41.42,-12.53,;41.03,-11.05,;39.54,-10.65,;39.14,-9.16,;40.23,-8.07,;39.83,-6.6,;41.72,-8.47,;42.11,-9.96,)|
CSCC[C@@H]1NC(=O)CNC(=O)[C@H](CSCc2ccc(cc2)-c2ccc(CSC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC1=O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc3c(c1)C(=O)OC31c3ccc(O)cc3Oc3cc(O)ccc13)C(N)=O)cc2)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CN |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CSCc2ccc(cc2)-c2ccc(CSC[C@H](NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc3c(c1)C(=O)OC31c3ccc(O)cc3Oc3cc(O)ccc13)C(N)=O)cc2)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CSCC(=O)NCCCCNC(=O)CSC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CSCC[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@H]1CSCC(=O)NCCCCNC(=O)CSC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CSCC[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@H]1CSCC(=O)NCCCCNC(=O)CSC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)C(CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@H]1CSCC(=O)NCCCCNC(=O)CSC[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@H]1CSCC(=O)NCCCCCNC(=O)CSC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCSC)NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CSCC[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](CCCCNC(=O)c1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc12)C(N)=O |r|
CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1ccc2ccccc2c1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1ccc2ccccc2c1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)CS(=O)(=O)N(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1ccc2ccccc2c1)CC(=O)N[C@@H](CC1CCC1)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1cccc2ccccc12)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
[#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#7](-[#6]-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6](-[#7]-[#6](-[#6])=O)-[#6@H](-[#6])-[#8])S([#6])(=O)=O)S(=O)(=O)c1ccc(cc1)-[#6](=[#6](\c1ccccc1)-c1ccccc1)\c1ccccc1)S(=O)(=O)[#6]-[#6](-[#6])-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#8])-[#6]-[#7](-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6])-[#6](-[#7])=O)S([#6])(=O)=O |r|
COc1ccc(cc1)S(=O)(=O)N(C[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)CC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)CN(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O)S(=O)(=O)CC(C)C |r|
CC(C)C[C@H](NC(=O)CN(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1ccc(Cl)cc1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1ccc(Br)cc1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)CN(C[C@H](Cc1ccccc1)NC(=O)C(NC(C)=O)[C@H](C)O)S(C)(=O)=O)S(=O)(=O)c1ccc(cc1)C(F)(F)F)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@@H](CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O)NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN(C[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)CN(C[C@@H](NC(=O)[C@H](CC(C)C)NC(C)=O)[C@@H](C)O)S(=O)(=O)Cc1ccccc1)S(=O)(=O)CC(C)C)S(=O)(=O)CCN |r|
COc1ccc(cc1)S(=O)(=O)N(C[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN(C[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(C)=O)S(C)(=O)=O)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CN(CC(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)CN(CC(=O)N[C@@H](C)C(N)=O)S(=O)(=O)CC(C)C)S(C)(=O)=O)Cc1c[nH]c2ccccc12 |r|
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)CN(C[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)S(C)(=O)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)CN(CC(=O)N[C@@H](C)C(=O)N1)S(=O)(=O)c1ccc2ccccc2c1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)CN(C[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)CCc2ccccc2)[C@@H](C)O)S(C)(=O)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)CN(CC(=O)N[C@@H](C)C(=O)N1)S(=O)(=O)c1ccc2ccccc2c1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)CN(C[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)S(C)(=O)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)CN(CC(=O)N[C@@H](C)C(=O)N1)S(=O)(=O)c1ccc2ccccc2c1)S(=O)(=O)CC(C)C)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CN(C[C@@H]1CCCCNC(=O)CC[C@H](NC(=O)CN(C[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)S(C)(=O)=O)C(=O)N[C@@H](Cc2ccc(O)cc2)CN(CC(=O)N[C@@H](C)C(=O)N1)S(=O)(=O)c1ccc2ccccc2c1)S(C)(=O)=O)C(=O)N[C@@H](CO)CN(CC(=O)N[C@@H](C)C(N)=O)S(C)(=O)=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccc(F)cc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccc(Cl)cc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3cc(Cl)ccc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccc(Br)cc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3cc(Br)ccc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccc(cc23)[N+]([O-])=O)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccc(C)cc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2cccc(F)c2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccc(F)cc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccccc2Cl)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccc(Cl)cc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccccc2Br)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2cccc(Br)c2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccc(Br)cc2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccc(cc2)[N+]([O-])=O)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccccc2C)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccc(C)cc2)c1[N+]([O-])=O |r|
COc1ccccc1[C@H]1[C@@H](N[C@]2([C@@H]1c1onc(C)c1[N+]([O-])=O)C(=O)Nc1ccccc21)C(F)(F)F |r|
CC(C)c1ccc(cc1)[C@H]1[C@@H](N[C@]2([C@@H]1c1onc(C)c1[N+]([O-])=O)C(=O)Nc1ccccc21)C(F)(F)F |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2cc(Cl)ccc2Cl)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccc(Cl)c(Cl)c2)c1[N+]([O-])=O |r|
COc1ccc(cc1OC)[C@H]1[C@@H](N[C@]2([C@@H]1c1onc(C)c1[N+]([O-])=O)C(=O)Nc1ccccc21)C(F)(F)F |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2ccco2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2cccs2)c1[N+]([O-])=O |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)C(F)(F)F)c2cccc3ccccc23)c1[N+]([O-])=O |r|
CN1C(=O)[C@@]2(N[C@H]([C@@H]([C@H]2c2onc(C)c2[N+]([O-])=O)c2ccccc2)C(F)(F)F)c2ccccc12 |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)N(CC=C)c3ccccc23)C(F)(F)F)c2ccccc2)c1[N+]([O-])=O |r|
CC(=O)N1C(=O)[C@@]2(N[C@H]([C@@H]([C@H]2c2onc(C)c2[N+]([O-])=O)c2ccccc2)C(F)(F)F)c2ccccc12 |r|
Cc1noc([C@@H]2[C@H]([C@@H](N[C@@]22C(=O)Nc3ccccc23)c2ccccc2)c2ccccc2)c1[N+]([O-])=O |r|
CCOC(=O)c1[nH]c2cc(Cl)ccc2c1C(N(Cc1cc(F)c(F)c(F)c1)C(=O)CCCCC#C)C(=O)NC(C)(C)C
CCC[C@H]1N(CCC[C@@]1(Oc1csc(c1)C(F)(F)F)C(=O)N1CCC(O)(CC1)c1ccccc1O[C@H](C)CCC1(CCC1)C(O)=O)C(=O)c1ncccc1C(F)(F)F |r|
Cc1c(Cl)ccc2cc(\C=C3/NC(=O)N(C(C(=O)NC(CO)CO)c4ccc(F)c(F)c4)C3=O)[nH]c12
CC(C)(C)Oc1cc(ccc1C1=N[C@H]([C@H](N1C(=O)N1CCNC(=O)C1)c1c[nH]c2ccc(Cl)cc12)c1ccc(cc1)C(O)=O)C(=O)CC(N)=O |r,t:12|
COc1cc(Cc2c([nH]c3ccccc23)-c2ccn(c2)S(=O)(=O)c2ccccc2)cc(O)c1OC
CN1CCC(=O)NCCSCCS(=O)(=O)CCN(Cc2ccc(cc2)C#N)CC(=O)N[C@@H](Cc2cc3ccc(Cl)cc3[nH]2)C1=O |r|
CCOc1cc(ccc1C1=NC(C(N1C(=O)N1CCN(CC(=O)NCCOCCOCCOCCNC(=O)CN2CCN(CC2=O)C(=O)N2C(C(N=C2c2ccc(cc2OCC)C(C)(C)C)c2ccc(Cl)cc2)c2ccc(Cl)cc2)C(=O)C1)c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(C)(C)C |c:54,t:10|
CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@](C)(CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCCCCNC(=O)C(CCCCN)NC(C)=O)[C@@H](C)O |r,t:59|
CC(C)C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@](C)(CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CCCCCNC(=O)C(CCCCNC(=O)c1cccc(I)c1)NC(C)=O)[C@@H](C)O |r,t:59|
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1 |r|
CC(C)C[C@H](NC(=O)C(=O)c1c([nH]c2ccccc12)-c1ccccc1)C(=O)N[C@H](Cc1ccccc1)C(O)=O |r|
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)C(=O)c1c([nH]c2ccc(cc12)N=C=S)-c1ccccc1 |r|
Fc1cccc(c1)-c1ccc2c(N3CCN(CC3)C(=O)C=C)n(Cc3ccccc3)nc2c1
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](C)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1ncc(-c2nc3C(=O)N([C@@H](C)c4cccc(Cl)c4)[C@H](c3n2C(C)C)c2ccc(Cl)cc2)c(OC)n1 |r|
C[C@@H](c1ccc(Cl)cc1Cl)n1cnc(c1-c1c([nH]c2cc(Cl)ccc12)C(=O)Nc1cc(ccc1N1CCC(CC1)N1CCCOC1=O)C(O)=O)-c1ccccc1 |r,wU:1.0,(-6.38,.63,;-5.61,1.97,;-6.38,3.3,;-7.92,3.3,;-8.68,4.63,;-7.91,5.97,;-8.68,7.3,;-6.38,5.97,;-5.6,4.64,;-4.06,4.64,;-4.07,1.97,;-3.23,3.26,;-1.74,2.86,;-1.66,1.32,;-3.1,.77,;-3.5,-.72,;-2.59,-1.96,;-3.5,-3.21,;-4.96,-2.73,;-6.29,-3.5,;-7.62,-2.74,;-8.96,-3.51,;-7.62,-1.19,;-6.29,-.42,;-4.96,-1.19,;-1.05,-1.96,;-.28,-.63,;-.28,-3.3,;-1.05,-4.63,;-2.6,-4.63,;-3.36,-5.97,;-2.59,-7.29,;-1.05,-7.29,;-.28,-5.96,;1.26,-5.96,;2.03,-4.63,;3.57,-4.63,;4.34,-5.96,;3.57,-7.3,;2.03,-7.3,;5.88,-5.96,;6.65,-7.3,;8.19,-7.3,;8.96,-5.96,;8.19,-4.63,;6.65,-4.63,;5.88,-3.3,;-4.9,-5.97,;-5.67,-4.63,;-5.67,-7.3,;-.17,1.72,;.22,3.21,;1.71,3.61,;2.8,2.52,;2.4,1.03,;.92,.63,)|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
CCNC[C@@]1([C@H](CC(C)(C)C)N[C@H]([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1ccc(cc1OC)C(O)=O)c1ccc(Cl)cc1F |r|
CCCNC[C@@]1([C@H](CC(C)(C)C)N[C@H]([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1ccc(cc1OC)C(O)=O)c1ccc(Cl)cc1F |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCC(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC(C)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
CCC(=O)NC[C@@]1([C@H](CC(C)(C)C)N[C@H]([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1ccc(cc1OC)C(O)=O)c1ccc(Cl)cc1F |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC(=O)C2CC2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC(=O)C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNS(=O)(=O)CC(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccccc2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccccc2O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2cccc(O)c2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccc(O)cc2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccccc2C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2cccc(c2)C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccc(cc2)C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccccn2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2cccnc2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccncc2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2cnn(C)c2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2cnc[nH]2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCC2CCNCC2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCC2CCOCC2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC2CCN(C)CC2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC2CCOCC2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC(=O)c2ccccc2)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNC(=O)c2ccc(cc2)C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNS(=O)(=O)c2ccccc2C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNS(=O)(=O)c2cccc(c2)C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNS(=O)(=O)c2ccc(cc2)C(O)=O)([C@H]1c1cccc(Cl)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNS(=O)(=O)c1cccc(c1)C(O)=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNCc1ccc(cc1)C(O)=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNc1ccc(CC(O)=O)cc1)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNc1ccc(O)nc1)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNc1cccc(c1)C(O)=O)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNc1cccnc1)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CN[C@H]1CC[C@H](O)CC1)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r,wU:17.19,8.8,5.4,23.25,wD:20.21,7.38,(1.08,-6.42,;1.08,-4.88,;2.42,-4.11,;2.42,-5.65,;-.25,-4.11,;-.25,-2.57,;.99,-1.66,;.52,-.2,;-1.02,-.2,;-2.56,2.47,;-4.11,2.47,;-4.87,3.81,;-4.1,5.13,;-2.56,5.13,;-1.79,6.46,;-1.79,3.8,;-.25,3.8,;-1.5,-1.66,;-1.78,-3.18,;-1.78,-4.72,;-3.11,-5.49,;-4.45,-4.72,;-5.78,-5.49,;-5.78,-7.03,;-7.11,-7.8,;-4.45,-7.8,;-3.11,-7.03,;-2.98,-2.06,;-3.38,-3.55,;-4.87,-3.95,;-5.96,-2.86,;-7.44,-3.26,;-5.56,-1.38,;-4.08,-.97,;-3.68,.52,;1.29,1.13,;.52,2.47,;2.83,1.13,;3.6,2.47,;5.14,2.47,;5.9,3.8,;5.13,5.13,;3.6,5.13,;2.82,3.81,;5.9,6.47,;7.44,6.47,;5.13,7.8,)|
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@@]1(CNCCO)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1)C(O)=O |r|
CNC[C@@]1([C@H](CC(C)(C)C)N[C@H]([C@@H]1c1cccc(Cl)c1F)C(=O)Nc1ccc(cc1)C(O)=O)c1ccc(Cl)cc1F |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccncc2)([C@H]1c1ccccc1Cl)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccncc2)([C@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccncc2)([C@H]1c1cccc(Cl)c1Cl)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccncc2)([C@H]1c1cccc(Cl)c1)c1ccc(Cl)cc1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CNCc2ccncc2)([C@H]1c1cccc(Cl)c1F)c1cc(Cl)ccc1F)C(O)=O |r|
Cc1ccc(NC(=O)Cn2cc(CN(C(C(=O)NC3CCCCC3)c3c[nH]c4cc(Cl)ccc34)C(=O)CCC(=O)OC(C)(C)C)nn2)c(C)c1
Nc1sc(c(c1C(=S)NC1CC1)-c1ccc(Cl)cc1)-c1ccc(Cl)cc1
CNC(=O)c1ccc(NC(=O)[C@@H]2NC3(CCCCC3)[C@]3([C@H]2c2cccc(Cl)c2F)C(=O)Nc2cc(Cl)ccc32)cc1 |r|
[H][C@@]12CN(C(=O)c3ccccc3)[C@@]([H])(C1)C(=O)N[C@@H](Cc1cn(CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)NCC(=O)NC[C@H](C(C)C)C(=O)N[C@@H](Cc3cccc(c3)C(F)(F)F)C(=O)N2)nn1)C(N)=O |r|
[H][C@@]12CN(C(=O)c3ccccc3)[C@@]([H])(C1)C(=O)N[C@H](Cc1cn(CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)NCC(=O)NC[C@H](C(C)C)C(=O)N[C@@H](Cc3cccc(c3)C(F)(F)F)C(=O)N2)nn1)C(N)=O |r|
CC[C@H](C)[C@@H]1NC(=O)[C@@H](NC(=O)Cn2cc(CC(NC(=O)[C@@H](Cc3ccsc3)NC(=O)[C@H](Cc3ccc(Cl)cc3)NC(=O)C[C@H](NC(=O)[C@H](CCSC)NC(=O)[C@H](CC(O)=O)NC1=O)C(O)=O)C(N)=O)nn2)C(C)C |r|
[H][C@@]12CN(C(=O)c3ccccc3)[C@@]([H])(C1)C(=O)NC(Cc1cn(CC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)N[C@@H](Cc3ccccc3)C(=O)NCC(=O)NC[C@H](C(C)C)C(=O)N[C@@H](Cc3cccc(c3)C(F)(F)F)C(=O)N2)nn1)C(N)=O |r|
CC(C)C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@](C)(CCCCCC\C=C\CCC[C@@](C)(NC(=O)[C@H](CC(C)C)NC1=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(C)=O)[C@@H](C)O |r,t:59|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(O)=O)NC1=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C)C(N)=O |r,t:39|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(O)=O)NC1=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(O)=O |c:39|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C/CCC[C@](C)(NC(=O)[C@H](CC2CCC2)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(O)=O)NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O |r,c:39|
CC(C)C[C@H](NC(C)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC\C=C\CCC[C@](C)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](Cc2cnc[nH]2)NC1=O)C(=O)N[C@@H](CO)C(N)=O |t:39|
O=C(C(Cc1ccccc1)C(=O)c1ccccc1)c1ccccc1
Fc1ccc(F)c(c1)C(=O)C(Cc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(c1)C(=O)C(Cc1cccc(Cl)c1)C(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(c1)C(=O)C(Cc1ccccc1Cl)C(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(c1)C(=O)C(Cc1cc(Cl)cc(Cl)c1)C(=O)c1ccc(Cl)cc1
Fc1cccc(CC(C(=O)c2ccc(Cl)cc2)C(=O)c2cc(F)ccc2F)c1
Fc1ccc(F)c(c1)C(=O)C(Cc1cccc(c1)C(F)(F)F)C(=O)c1ccc(Cl)cc1
COc1cccc(CC(C(=O)c2ccc(Cl)cc2)C(=O)c2cc(F)ccc2F)c1
Cc1cccc(CC(C(=O)c2ccc(Cl)cc2)C(=O)c2cc(F)ccc2F)c1
Fc1ccc(F)c(c1)C(=O)C(Cc1ccsc1)C(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(c1)C(=O)C(Cc1ccc(Cl)nc1)C(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(c1)C(=O)C(Cc1cc2ccccc2cn1)C(=O)c1ccc(Cl)cc1
Fc1ccc(F)c(c1)C(=O)C(Cc1ccc(cc1)-c1ccccc1)C(=O)c1ccc(Cl)cc1
O=C(C(Nc1ccccc1)c1ccccc1)c1ccccc1
COc1ccc(cc1)C(=O)C(Nc1ccccc1)c1ccccc1
Clc1ccc(cc1)C(=O)C(Nc1ccccc1)c1ccccc1
COc1ccc(cc1)C(Nc1ccc(C)cc1)C(=O)c1ccc(OC)cc1
Fc1ccc(cc1)C(=O)C(Nc1ccc(Cl)cc1)c1ccc(Cl)cc1
Clc1ccc(NC(C(=O)c2ccc(Br)cc2)c2ccc(Cl)cc2)cc1
COc1ccc(NC(C(=O)c2ccc(Cl)cc2)c2ccc(F)cc2Cl)cc1
Fc1ccc(C(Nc2ccc(Cl)cc2)C(=O)c2ccc(Cl)cc2)c(Cl)c1
Fc1ccc(F)c(c1)C(Nc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
Fc1ccc(cc1Cl)C(Nc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
Fc1cc(F)cc(c1)C(Nc1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
Cc1cc(Cl)cc(NC(C(=O)c2ccc(Cl)cc2)c2ccc(F)c(Cl)c2)c1
Cc1cc(Cl)cc(NC(C(=O)c2ccc(F)cc2)c2ccc(F)c(Cl)c2)c1
Fc1ccc(NC(C(=O)c2ccc(Cl)cc2)c2ccc(F)cc2Cl)cc1
Fc1ccc(C(Nc2cccc(Cl)c2)C(=O)c2ccc(Cl)cc2)c(Cl)c1
Fc1cc(F)cc(NC(C(=O)c2ccc(Cl)cc2)c2ccc(Cl)cc2F)c1
Fc1c(Cl)cccc1NC(C(=O)c1ccc(Cl)cc1)c1ccc(Cl)c(Cl)c1
Fc1cc(F)cc(NC(C(=O)c2ccc(Cl)cc2)c2ccc(Cl)c(Cl)c2)c1
Clc1ccc(cc1)C(=O)C(Nc1ccc(Cl)c(Cl)c1)c1ccc(Cl)c(Cl)c1
COC(=O)\C=C\C(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
COC(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
COC(=O)CCCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
COC(=O)CCCCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
OC(=O)\C=C\C(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
OC(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
OC(=O)CCCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
OC(=O)CCCCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
COc1ccc(cc1)S(=O)(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
CN(C)C1CCN(CC1)C(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
CCN1CCN(CC1)C(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
CC(=O)N1CCN(CC1)C(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
OCCN1CCN(CC1)C(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
Fc1ccc(C(N(C(=O)CCC(=O)NCCN2CCOCC2)c2ccc(Cl)cc2)C(=O)c2ccc(Cl)cc2)c(Cl)c1
CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CCC(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
Fc1ccc(C(N(C(=O)CCC(=O)N2CCNCC2)c2ccc(Cl)cc2)C(=O)c2ccc(Cl)cc2)c(Cl)c1
COC(=O)c1ccc(NC(=O)CCC(=O)N(C(C(=O)c2ccc(Cl)cc2)c2ccc(F)cc2Cl)c2ccc(Cl)cc2)cc1
COC(=O)c1ccc(cc1)C(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
OC(=O)c1ccc(cc1)C(=O)N(C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl)c1ccc(Cl)cc1
CCOc1cc(ccc1C1=N[C@@](C)(c2ccc(Cl)cc2)[C@](N)(N1C(=O)N1CCN(CCCS(C)(=O)=O)CC1)c1ccc(Cl)cc1)C(C)(C)C |r,t:10|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1ccccc1Cl)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(Cl)c1)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1ccc(Cl)cc1)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(Cl)c1Cl)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(C)c1)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(c1)C(F)(F)F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cccc(c1)[C@H]1[C@@H](N[C@@H](CC(C)(C)C)[C@]1(CN)c1ccc(Cl)cc1F)C(=O)Nc1ccc(cc1OC)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1ccccc1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(F)c1)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1ccc(F)cc1)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(F)c1F)c1ccc(Cl)cc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1ccccc1Cl)c1cc(Cl)ccc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(Cl)c1)c1cc(Cl)ccc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1ccc(Cl)cc1)c1cc(Cl)ccc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@](CN)([C@H]1c1cccc(Cl)c1Cl)c1cc(Cl)ccc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(Cl)c1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1ccccc1Cl)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(Cl)c1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1ccc(Cl)cc1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(Cl)c1Cl)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(C)c1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(c1)C(F)(F)F)C(O)=O |r|
COc1cccc(c1)[C@H]1[C@@H](N[C@@H](CC(C)(C)C)[C@@]11CNc2cc(Cl)ccc12)C(=O)Nc1ccc(cc1OC)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1ccccc1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(F)c1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1ccc(F)cc1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]1c1cccc(F)c1F)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3ccc(Cl)cc23)[C@H]1c1ccccc1Cl)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3ccc(Cl)cc23)[C@H]1c1cccc(Cl)c1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3ccc(Cl)cc23)[C@H]1c1ccc(Cl)cc1)C(O)=O |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CNc3ccc(Cl)cc23)[C@H]1c1cccc(Cl)c1Cl)C(O)=O |r|
CNC(=O)c1ccc(NC(=O)[C@@H]2N[C@@H](CC(C)(C)C)[C@@]3(CNc4cc(Cl)ccc34)[C@H]2c2cccc(Cl)c2F)c(OC)c1 |r|
COc1cc(ccc1NC(=O)[C@@H]1N[C@@H](CC(C)(C)C)[C@@]2(CN(C)c3cc(Cl)ccc23)[C@H]1c1cccc(Cl)c1F)C(O)=O |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1F |r|
COc1cc(ccc1NC(=O)[C@H]1[C@H](c2cccc(Cl)c2F)[C@]2(CNc3cc(Cl)ccc23)[C@H](CC(C)(C)C)N1C)C(O)=O |r|
CCCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1F |r|
CCCCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1F |r|
COc1cc(ccc1NC(=O)[C@H]1[C@H](c2cccc(F)c2F)[C@]2(CNc3cc(Cl)ccc23)[C@H](CC(C)(C)C)N1C)C(O)=O |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(F)c1F |r|
CCCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(F)c1F |r|
CCCCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(F)c1F |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1ccccc1Cl |r|
CCN1[C@H](CC(C)(C)C)[C@]2(CNc3cc(Cl)ccc23)[C@@H]([C@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1 |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1ccc(Cl)cc1 |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1Cl |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(C)c1 |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(OC)c1 |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1ccccc1F |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(F)c1 |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3ccc(Cl)cc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1Cl |r|
CCN1[C@@H](CC(C)(C)C)[C@@]2(CNc3cc(Cl)ccc23)[C@H]([C@@H]1C(=O)Nc1ccc(cc1OC)C(O)=O)c1cccc(Cl)c1 |r|
C[C@H](CC(=O)C[C@@H](C)C(O)=O)[C@H]1C[C@@H](O)[C@@]2(C)C3=C(C(=O)C[C@@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@H]1C[C@@H]3O |r,c:17,@:30|
Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCc2cn(CCOCCOCCOCCNC(=O)[C@H](C)CC(=O)C[C@@H](C)[C@H]3C[C@H](O)[C@@]4(C)C5=C(C(=O)C[C@]34C)[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3C[C@@H]5O)nn2)C(C)(C)C)cc1
Cc1ncsc1-c1ccc([C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCc2cn(CCOCCOCCOCCOCCNC(=O)[C@H](C)CC(=O)C[C@@H](C)[C@H]3C[C@H](O)[C@@]4(C)C5=C(C(=O)C[C@]34C)[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3C[C@@H]5O)nn2)C(C)(C)C)cc1
Cc1c(ccc2c1nn3c2C[C@H]4[C@@H]3[C@@H]([C@]5(N4CC6CC6)c7ccc(cc7NC5=O)Cl)c8cccc(c8F)Cl)C(=O)O
COc1cc2c(cc1OC(C)C)[C@H](c1ccc(Cl)cc1)N(c1ccc(N(C)C[C@H]3CC[C@H](N4CCN(C)C(=O)C4)CC3)cc1)C(=O)C2
O=C1CN(C(=O)N2C(c3ccc4c(c3)C(=O)NCC(=O)N4c3ccccc3)=N[C@@H](c3ccc(Cl)cc3)[C@H]2c2ccc(Cl)cc2)CCN1
CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)C(C)C)[C@H](C)O
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)C(C)C)[C@@H](C)O)[C@@H](C)O
CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)C(C)C)[C@@H](C)O
CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)[C@@H](C)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)O)C(C)C
CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(N)=O)[C@@H](C)O
CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(N)=O)[C@@H](C)O
CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(N)=O)[C@@H](C)O
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC#N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O)[C@@H](C)O
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O)[C@@H](C)O
CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O)[C@@H](C)O
CN(C)C1CCN(C(=O)CCC(=O)C(c2ccc(Cl)cc2)C(C(=O)c2ccc(Cl)cc2)c2ccc(F)cc2Cl)CC1
O=C(CCC(=O)N1CCNCC1)C(c1ccc(Cl)cc1)C(C(=O)c1ccc(Cl)cc1)c1ccc(F)cc1Cl
O=C1CN(C(=O)N2C(c3ccc4c(c3)NC(=O)CNC4=O)=N[C@@H](c3ccc(Cl)cc3)[C@H]2c2ccc(Cl)cc2)CCN1
O=C1CN(C(=O)N2C(c3ccc4c(c3)N(c3ccccc3)C(=O)CNC4=O)=N[C@@H](c3ccc(Cl)cc3)[C@H]2c2ccc(Cl)cc2)CCN1
CCOC(=O)C1=NN(C2CCCCC2)[C@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
CCOC(=O)C1=NN(c2ccc(Cl)cc2)[C@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(Cl)c1F
O=C(Nc1cccc(-n2ccc(-c3ccccc3)n2)c1)C1=NN(c2ccc(Cl)cc2)[C@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(O)c1
O=C(Nc1cccc(-n2cccn2)c1)C1=NN(c2ccc(Cl)cc2)[C@]2(C(=O)Nc3cc(Cl)ccc32)[C@H]1c1cccc(O)c1
COc1cc(Cc2c(-c3ccccc3)[nH]c3cc(C)ccc23)cc(OC)c1OC
COc1cc(C(O)c2c(-c3cc[nH]c3)[nH]c3ccccc23)cc(OC)c1OC
COc1cc(Cc2c(-c3ccn(S(=O)(=O)c4ccccc4)c3)[nH]c3ccccc23)cc(OC)c1OC
COc1cccc2c1NCC2C(=O)N[C@H]1CCN(c2ccc(C)cc2)C1
CC(C)C(=O)Nc1ccccc1SC(=O)C(C)C
Oc1ccc(cc1)-c1cc(=O)c2c(O)c(Oc3ccc(cc3)-c3cc(O)c4c(cc(O)cc4=O)o3)c(O)cc2o1
CC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@]1(C)CCCCCC/C=CCCC[C@@](C)(C(=O)NCOCCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N2CC(O)CC2C(=O)N[C@@H](Cc2ccc(O)cc2)C(=O)NC(CCC(C)C)C(=O)N2CCC[C@H]2C(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](Cc2cc3ccccc3[nH]2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(=O)O)NC1=O)[C@@H](C)O