3530 SMILES Strings for Serine/threonine-protein kinase pim-2

Compound Name
SMILES String
Cc1ccc(C=C2SC(O)=NC2=O)cc1 |w:5.4,c:9|
Cc1cccc(C=C2SC(O)=NC2=O)c1 |w:6.5,c:10|
OC1=NC(=O)C(S1)=Cc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cccc(c1)C(F)(F)F |w:7.8,t:1|
FC(F)(F)Oc1ccc(CN2C(=O)S\C(=C/c3cccc(c3)C(F)(F)F)C2=O)cc1
COCOc1c(C=C2SC(O)=NC2=O)cccc1C(F)(F)F |w:6.5,c:10|
COCCOc1c(C=C2SC(O)=NC2=O)cccc1C(F)(F)F |w:7.6,c:11|
CCc1ccc(C=C2SC(O)=NC2=O)cc1 |w:6.5,c:10|
CC(C)c1ccc(C=C2SC(O)=NC2=O)cc1 |w:7.6,c:11|
COc1ccc(C=C2SC(O)=NC2=O)cc1 |w:6.5,c:10|
OC1=NC(=O)C(S1)=Cc1ccc(OC(F)(F)F)cc1 |w:7.8,t:1|
COc1cccc(C=C2SC(O)=NC2=O)c1 |w:7.6,c:11|
OC1=NC(=O)C(S1)=Cc1cccc(OC(F)(F)F)c1 |w:7.8,t:1|
CCOc1ccc(C=C2SC(O)=NC2=O)cc1 |w:7.6,c:11|
OC1=NC(=O)C(S1)=Cc1cccc(OC(F)(F)C(F)F)c1 |w:7.8,t:1|
CCCOc1ccc(C=C2SC(O)=NC2=O)cc1 |w:8.7,c:12|
CN(C)c1ccc(C=C2SC(O)=NC2=O)cc1 |w:7.6,c:11|
OC1=NC(=O)C(S1)=Cc1ccc(F)cc1 |w:7.8,t:1|
Fc1ccc(\C=C2/SC(=O)N(Cc3ccccc3F)C2=O)cc1
OC1=NC(=O)C(S1)=Cc1cccc(F)c1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(Cl)cc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cccc(Cl)c1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(Br)cc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cccc(Br)c1 |w:7.8,t:1|
Oc1csc(=O)n1Cc1ccccc1F
Clc1ccc(C=C2N(Cc3ccccc3)C(=O)NC2=O)cc1
COc1ccc(\C=C2\N(Cc3ccccc3)C(=O)NC2=O)cc1
COc1ccc(C=C2N(Cc3ccccc3)C(=O)NC2=O)cc1
CCOc1ccc(C=C2N(Cc3ccccc3)C(=O)NC2=O)cc1
Brc1ccc(\C=C2\N(Cc3ccccc3)C(=O)NC2=O)cc1
CN(C)c1ccc(\C=C2\N(Cc3ccccc3)C(=O)NC2=O)cc1
COc1ccccc1C=C1N(Cc2ccccc2)C(=O)NC1=O
CCn1c2noc(=O)c2c(O)c2cc(F)c(Cl)cc12
CC(C)n1c2noc(=O)c2c(O)c2cc(F)c(Cl)cc12
CCCCn1c2noc(=O)c2c(O)c2cc(F)c(Cl)cc12
Oc1c2c(noc2=O)n(Cc2ccccc2)c2cc(Cl)c(F)cc12
CCn1c2n(C)oc(=O)c2c(=O)c2cc(F)c(Cl)cc12
CCn1c2n(Cc3ccccc3)oc(=O)c2c(=O)c2cc(F)c(Cl)cc12
CCn1c2n(Cc3cccc(O)c3)oc(=O)c2c(=O)c2cc(F)c(Cl)cc12
CCn1c2n(CCOCc3ccccc3)oc(=O)c2c(=O)c2cc(F)c(Cl)cc12
CCn1c2n(CCO)oc(=O)c2c(=O)c2cc(F)c(Cl)cc12
CCn1c2noc(=O)c2c(O)c2cc(OC)c(Cl)cc12
CCn1c2noc(=O)c2c(O)c2cc(O)c(Cl)cc12
CN1CCCN(CC1)c1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
COC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCCN(C)CC1
CN1CCCN(CC1)c1cncc(n1)-c1cccc(\C=C\C(N)=O)c1
CN1CCCN(CC1)c1cncc(n1)-c1cccc(CCC(O)=O)c1
CN1CCCN(CC1)c1cncc(n1)-c1cccc(C=Cc2nnn[nH]2)c1 |w:19.20|
CN1CCCN(CC1)c1cnccn1
OC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCCNCC1
OC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCCCCC1
CC(=O)N1CCCN(CC1)c1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
CN1CCN(CC1)c1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
OC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCNCC1
OC(=O)\C=C\c1cccc(c1)-c1cncc(n1)N1CCOCC1
NCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
NCCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
NCCCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
CN(C)CCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
CN(C)CCCN(C)c1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
CC(=O)NCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
OCCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
COCCCNc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
OC(=O)\C=C\c1cccc(c1)-c1cncc(NCC2CCNCC2)n1
NCC1CCN(CC1)c1cncc(n1)-c1cccc(\C=C\C(O)=O)c1
N[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1 |r,wU:4.7,wD:1.0,(-2.78,-3.68,;-2.78,-2.14,;-1.45,-1.37,;-1.45,.17,;-2.78,.94,;-4.12,.17,;-4.12,-1.37,;-2.78,2.48,;-1.45,3.25,;-1.45,4.8,;-.12,5.57,;1.22,4.8,;1.22,3.25,;-.12,2.48,;2.55,2.48,;3.88,3.26,;5.22,2.48,;5.22,.94,;3.88,.17,;3.88,-1.37,;5.22,-2.14,;5.22,-3.68,;6.55,-4.45,;3.88,-4.45,;2.55,.94,)|
N[C@H]1CC[C@H](CC1)Nc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1 |r,wD:4.7,1.0,(-2.78,-3.68,;-2.78,-2.14,;-1.45,-1.37,;-1.45,.17,;-2.78,.94,;-4.12,.17,;-4.12,-1.37,;-2.78,2.48,;-1.45,3.25,;-1.45,4.8,;-.12,5.57,;1.22,4.8,;1.22,3.25,;-.12,2.48,;2.55,2.48,;3.88,3.26,;5.22,2.48,;5.22,.94,;3.88,.17,;3.88,-1.37,;5.22,-2.14,;5.22,-3.68,;6.55,-4.45,;3.88,-4.45,;2.55,.94,)|
O[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1cccc(\C=C\C(O)=O)c1 |r,wU:4.7,wD:1.0,(-2.78,-3.68,;-2.78,-2.14,;-1.45,-1.37,;-1.45,.17,;-2.78,.94,;-4.12,.17,;-4.12,-1.37,;-2.78,2.48,;-1.45,3.25,;-1.45,4.8,;-.12,5.57,;1.22,4.8,;1.22,3.25,;-.12,2.48,;2.55,2.48,;3.88,3.26,;5.22,2.48,;5.22,.94,;3.88,.17,;3.88,-1.37,;5.22,-2.14,;5.22,-3.68,;6.55,-4.45,;3.88,-4.45,;2.55,.94,)|
OC(=O)\C=C\c1cccc(c1)-c1cnccn1
CN1CCCN(CC1)c1cccc(n1)-c1cccc(\C=C\C(O)=O)c1
Clc1ccc2sc3c(nc[nH]c3=O)c2c1
CN(C)Cc1nc2c3cc(Cl)ccc3sc2c(=O)[nH]1
Clc1ccc2sc3c(nc(CN4CCCCC4)[nH]c3=O)c2c1
Clc1ccc2sc3c(nc(CN4CCCNC4)[nH]c3=O)c2c1
Clc1ccc2sc3c(nc(CN4CCOCC4)[nH]c3=O)c2c1
O[C@H]1CCN(Cc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)C1 |r|
O[C@@H]1CCN(Cc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)C1 |r|
OC1CCCN(Cc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)C1
OC1CCN(Cc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)CC1
CNCc1nc2c3cc(Cl)ccc3sc2c(=O)[nH]1
CN(C)CCc1nc2c3cc(Cl)ccc3sc2c(=O)[nH]1
CN(C)CCCc1nc2c3cc(Cl)ccc3sc2c(=O)[nH]1
Clc1ccc2sc3c(nc(CNc4ccccc4)[nH]c3=O)c2c1
Oc1ccccc1NCc1nc2c3cc(Cl)ccc3sc2c(=O)[nH]1
Oc1cccc(NCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)c1
Oc1ccc(NCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)cc1
COc1cccc(NCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)c1
Oc1cc(O)cc(NCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)c1
Cc1c(O)cccc1NCc1nc2c3cc(Cl)ccc3sc2c(=O)[nH]1
Cc1ccc(NCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)cc1O
Oc1cccc(CCNCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)c1
Oc1cccc(OCc2nc3c4cc(Cl)ccc4sc3c(=O)[nH]2)c1
CN(C)Cc1nc2c3cc(Br)ccc3sc2c(=O)[nH]1
CN(C)Cc1nc2c3ccccc3sc2c(=O)[nH]1
CN(C)Cc1nc2c3cc(C)ccc3sc2c(=O)[nH]1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)C(F)(F)F
CCc1ccc2sc3c(nc(CN(C)C)[nH]c3=O)c2c1
CC(C)c1ccc2sc3c(nc(CN(C)C)[nH]c3=O)c2c1
CN(C)Cc1nc2c3cc(C=C)ccc3sc2c(=O)[nH]1
CN(C)CC1=Nc2c3cc(ccc3sc2C(=O)N1)/C=C/C4CC4
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)C#C
CN(C)CC#Cc1ccc2sc3c(nc(CN(C)C)[nH]c3=O)c2c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)C#CCCCCN1CCCCC1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccccc1
CC(c1ccccc1)c1ccc2sc3c(nc(CN(C)C)[nH]c3=O)c2c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cccc(F)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cccc(Cl)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cccc(OC(F)(F)F)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cccc(O)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccccc1C
CCc1ccc(cc1)-c1ccc2sc3c(nc(CN(C)C)[nH]c3=O)c2c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(cc1)C#N
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(O)cc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(N)cc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(OC(F)(F)F)cc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(O)c(F)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(cc1)N(C)C
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(Cl)c(F)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cc(F)cc(Cl)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cc(Cl)cc(Cl)c1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccsc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc[nH]1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccoc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cscc1C
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cccnc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1cncnc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)N1CCCC1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)N1CCCCC1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(OCC(O)CO)cc1
CN(C)Cc1nc2c3cc(ccc3sc2c(=O)[nH]1)-c1ccc(OCCCN)cc1
Oc1cccc(NCc2nc3c4cc(Br)ccc4sc3c(=O)[nH]2)c1
Oc1cccc(NCc2nc3c4cc(ccc4sc3c(=O)[nH]2)-c2ccsc2)c1
Oc1cccc(NCc2nc3c4cc(ccc4sc3c(=O)[nH]2)-c2ccccc2)c1
O[C@H]1CCN(Cc2nc3c4cc(ccc4sc3c(=O)[nH]2)-c2ccsc2)C1 |r|
O[C@H]1CCN(Cc2nc3c4cc(ccc4sc3c(=O)[nH]2)-c2ccccc2)C1 |r|
O[C@H]1CCN(Cc2nc3c4cc(ccc4sc3c(=O)[nH]2)-c2ccc(O)cc2)C1 |r|
O[C@H]1CCN(Cc2nc3c4cc(ccc4sc3c(=O)[nH]2)-c2ccc(cc2)C#N)C1 |r|
O[C@H]1CCN(Cc2nc3c4cc(\C=C\C5CC5)ccc4sc3c(=O)[nH]2)C1 |r|
c1cc(c2c(c1Cl)c3c(s2)C(=O)NC=N3)Cl
CC(=O)c1cccc(c1)-c1cnc2ccc(NCC3CC3)nn12
Clc1cccc(c1)-c1cnc2ccc(NC3CCOCC3)nn12
CCC(CO)Nc1ccc2ncc(-c3ccc(F)c(Cl)c3)n2n1
CN1CCC([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl
CN(C)C[C@@H]1CCn2cc(C3=C(C(=O)NC3=O)c3cn(CCO1)c1ccccc31)c1ccccc21 |r,t:10|
CN[C@H]1C[C@@H]2O[C@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
N=C1NC(=O)\C(S1)=C/c1ccc(o1)-c1cncc2ccccc12
C1CC(CCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12
FC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCNCC1
CCc1cccc(CC)c1NC(=O)c1cn(C)c-2c1CCCc1cnc(Nc3ccc(cc3OC)N3CCN(C)CC3)nc-21
O=Cc1c[nH]c2c1ccc1c3ccccc3[nH]c21
CC(Sc1nc2n(ncc2c(=O)[nH]1)-c1cccc(Cl)c1)C(N)=O
OCCSc1nc2n(ncc2c(=O)[nH]1)-c1cccc(Cl)c1
C1CC(CCN1)Nc1cccc2ccc(nc12)-c1nnc2ccccn12
CC1(C)CC(CC(C)(C)N1)Nc1cccc2ccc(nc12)-c1nnc2ccccn12
OC1CCC(CC1)Nc1cccc2ccc(nc12)-c1nnc2ccccn12 |(7.6,3.85,;6.26,3.08,;6.26,1.54,;4.93,.77,;3.6,1.54,;3.6,3.08,;4.93,3.85,;2.26,.77,;2.26,-.77,;3.6,-1.54,;3.6,-3.08,;2.26,-3.85,;.93,-3.08,;-.4,-3.85,;-1.74,-3.08,;-1.74,-1.54,;-.4,-.77,;.93,-1.54,;-3.07,-.77,;-3.07,.77,;-4.54,1.25,;-5.44,,;-6.97,-.16,;-7.6,-1.57,;-6.69,-2.81,;-5.16,-2.65,;-4.54,-1.25,)|
C1C[C@@H](CN1)Nc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
C1C[C@H](CN1)Nc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CC(C)(C)OC(=O)NCCCNc1cccc2ccc(nc12)-c1nnc2ccccn12
NCCCNc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)CCN(CCCN)c1cccc2ccc(nc12)-c1nnc2ccccn12
NCCCOc1cccc2ccc(nc12)-c1nnc2ccccn12
C1C[C@H](CN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
C1C[C@@H](CN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
COC(=O)[C@@H]1C[C@H](CCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)C1CCNCC1
C(CC1CCCCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)C1CCCNC1
NC1CCC(CC1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |(7.59,3.85,;6.26,3.08,;6.26,1.54,;4.93,.77,;3.6,1.54,;3.6,3.08,;4.93,3.85,;2.27,.77,;2.27,-.77,;3.61,-1.54,;3.61,-3.08,;2.27,-3.85,;.94,-3.08,;-.4,-3.85,;-1.73,-3.08,;-1.73,-1.54,;-.4,-.77,;.94,-1.54,;-3.06,-.77,;-3.06,.77,;-4.53,1.25,;-5.43,0,;-6.96,-.16,;-7.59,-1.56,;-6.69,-2.81,;-5.15,-2.65,;-4.53,-1.24,)|
CC(C)(CN)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)(CO)COc1cccc2ccc(nc12)-c1nnc2cc(CN)ccn12
CC(C)COc1cccc2ccc(nc12)-c1nnc2cc(CN)ccn12
CN(C)CC(C)(C)COc1cccc2ccc(nc12)-c1nnc2ccccn12
OCC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CC1
CC(C)(C)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)(CO)COc1cccc2ccc(nc12)-c1nnc2ccccn12
F[C@H]1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
F[C@@H]1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CCNCC(C)(C)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CNCC(C)(C)COc1cccc2ccc(nc12)-c1nnc2ccccn12
C1CC2CC(CC1N2)Oc1cccc2ccc(nc12)-c1nnc2ccccn12
CC[C@@H](CN)C(CC)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CC[C@H](CN)C(CC)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CC[C@@H](CN)C(C)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CC[C@H](CN)C(C)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CCCC(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)[C@@H](CC)CN |r|
CCCC(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)[C@H](CC)CN |r|
CC(C)(CN)COc1cc(F)cc2ccc(nc12)-c1nnc2ccccn12
NC(=O)N1CCC(CC1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12
NCC(F)(F)COc1cccc2ccc(nc12)-c1nnc2ccccn12
N[C@H]1CCC(CC1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r,wU:1.0,(7.59,3.85,;6.26,3.08,;6.26,1.54,;4.93,.77,;3.6,1.54,;3.6,3.08,;4.93,3.85,;2.27,.77,;2.27,-.77,;3.61,-1.54,;3.61,-3.08,;2.27,-3.85,;.94,-3.08,;-.4,-3.85,;-1.73,-3.08,;-1.73,-1.54,;-.4,-.77,;.94,-1.54,;-3.06,-.77,;-3.06,.77,;-4.53,1.25,;-5.43,0,;-6.96,-.16,;-7.59,-1.56,;-6.69,-2.81,;-5.15,-2.65,;-4.53,-1.24,)|
CC(C)(CN)COc1ccc(F)c2ccc(nc12)-c1nnc2ccccn12
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)c1cccnc1
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)c1ccncc1
FC1CCNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccccn12
FC1CNCCCC1Oc1cccc2ccc(nc12)-c1nnc2ccccn12
C1CNCCC(C1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12
CN(C)C(=O)[C@@H]1CC(CCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CON(C)C(=O)[C@@H]1CC(CCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
OC[C@@H]1CC(CCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
COC[C@@H]1CC(CCN1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12 |r|
CC(C)(CN)COc1c(Br)ccc2ccc(nc12)-c1nnc2ccccn12
FC1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(F)cn12
FC1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2cc(F)ccn12
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)[C@@H]1CCCN1 |r|
OCC(O)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)(CN)COc1cccc2ccc(nc12)-c1nnc2ccc(Br)cn12
CC(C)(CN)COc1cccc2ccc(nc12)-c1nnc2ccc(cn12)C1CC1
CC(C)(CN)COc1cccc2ccc(nc12)-c1nnc2ccc(cn12)-c1ccccc1
CC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCNCC1
CCC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCNCC1
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)C1(CC2CC2)CCNCC1
CC(C)C1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCNCC1
OC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCN(Cc2ccccc2)CC1
OC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCNCC1
COC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCNCC1
O(c1ccncc1)c1cccc2ccc(nc12)-c1nnc2ccccn12
Nc1cc(Oc2cccc3ccc(nc23)-c2nnc3ccccn23)ccn1
Nc1nccc(Oc2cccc3ccc(nc23)-c2nnc3ccccn23)n1
FC1(COc2cccc3ccc(nc23)-c2nnc3ccc(Br)cn23)CCNCC1
FC1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(Br)cn12
FC1(COc2cccc3ccc(nc23)-c2nnc3ccc(cn23)C2CC2)CCNCC1
FC1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(cn12)C1CC1
FC1(COc2cccc3ccc(nc23)-c2nnc3ccc(cn23)-c2ccccc2)CCNCC1
FC1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(cn12)-c1ccccc1
NC(=O)CN1CCC(F)(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CC1
CN1CCC(F)(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CC1
OCCN1CCC(F)(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CC1
CC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCN(CCO)CC1
FC1CNCCC1Oc1cc(F)cc2ccc(nc12)-c1nnc2ccccn12
FC1CCNCCC1Oc1cc(F)cc2ccc(nc12)-c1nnc2ccccn12
Cc1ccn2c(nnc2c1)-c1ccc2cccc(OC3CCNCCC3F)c2n1
Fc1cc(OC2CCNCC2(F)F)c2nc(ccc2c1)-c1nnc2ccccn12
FC1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccccn12
FC1CCNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(cn12)C1CC1
Cc1ccc2nnc(-c3ccc4cccc(OC5CCNCCC5F)c4n3)n2c1
FC1CCNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(cn12)[N+]#[C-]
FC1CCNCCC1Oc1cccc2ccc(nc12)-c1nnc2ccc(F)cn12
Fc1ccc2nnc(-c3ccc4cccc(OCC5(F)CCNCC5)c4n3)n2c1
CCN1CCC(F)(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CC1
FCCN1CCC(F)(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CC1
Fc1cc(OCC2(F)CCNCC2)c2nc(ccc2c1)-c1nnc2ccccn12
FC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CNC1
Fc1cc(OCC2(F)CNC2)c2nc(ccc2c1)-c1nnc2ccccn12
COc1ccc2nnc(-c3ccc4cccc(OCC5(F)CCNCC5)c4n3)n2c1
COc1ccc2nnc(-c3ccc4cc(F)cc(OCC5(F)CCNCC5)c4n3)n2c1
COCCOc1ccc2nnc(-c3ccc4cccc(OCC5(F)CCNCC5)c4n3)n2c1
CC(C)(COc1cc(F)cc2ccc(nc12)-c1nnc2ccccn12)[C@@H](O)CO |r|
CC(C)(COc1cccc2ccc(nc12)-c1nnc2ccccn12)[C@@H](O)CO |r|
COC1(COc2cc(F)cc3ccc(nc23)-c2nnc3ccccn23)CCCNCC1
COC1(COc2cc(F)cc3ccc(nc23)-c2nnc3ccccn23)CCCN(CCO)CC1
OC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCCNCC1
COC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCCNCC1
CN1CCC(F)C(CC1)Oc1cccc2ccc(nc12)-c1nnc2ccccn12
Cc1ccn2c(nnc2c1)-c1ccc2cccc(OCC(C)(C)CN)c2n1
F[C@@H]1CNCCC1Oc1cccc2ccc(nc12)-c1nnc2cc(Cl)ccn12 |r|
COC1(COc2cccc3ccc(nc23)-c2nnc3cc(C)ccn23)CCNCC1
C(Oc1cccc2ccc(nc12)-c1nnc2ccccn12)C1CNCCO1
NCC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCCC1
CCC(CO)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CCC(CC)(CO)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)(CCN)COc1cccc2ccc(nc12)-c1nnc2ccccn12
FC1(COc2cccc3ccc(nc23)-c2nnc3ccccn23)CCCNC1
CC(C)(CNC(=O)CF)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)(CNCC(F)F)COc1cccc2ccc(nc12)-c1nnc2ccccn12
CC(C)(CNCC(F)(F)F)COc1cccc2ccc(nc12)-c1nnc2ccccn12
C[C@@H]1C[C@H](O)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(O)cc1F |r,wU:7.8,wD:1.0,5.5,(-6,1.93,;-4.67,1.15,;-4.67,-.38,;-3.33,-1.15,;-2,-.38,;-2,1.15,;-.67,1.93,;-3.33,1.93,;-3.33,3.47,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:7.8,wD:1.0,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.38,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(O)cc1F |r,wU:7.8,wD:3.9,1.0,5.5,(-6,1.93,;-4.67,1.15,;-4.67,-.38,;-3.33,-1.15,;-2,-.38,;-2,1.15,;-.67,1.93,;-3.33,1.93,;-3.33,3.47,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(O)ccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1ccc(O)cc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1cc(O)ccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cc(O)cc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccc(O)cc1F |r|
CC1(C)C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccc(O)cc1F |r|
Cc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@H]1C[C@@H](N)CC(C)(C)C1 |r,wD:25.27,27.30,(6,5,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,;3.33,1.93,;4.67,2.69,;6,1.93,;3.33,.38,;2,-.38,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;.67,-2.69,;.67,-4.23,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-3.33,-5,;-4.67,-4.23,;-4.67,-2.69,;-3.33,-1.93,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.7,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,3.47,;-4.67,.38,)|
Cc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@H]1C[C@@H](N)CC(C)(C)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)ccc(C)c1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(F)cc(F)c1F |r|
CCc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)C1CCCCC1 |r|
CCc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](O)[C@H](N)C1 |r|
CCc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1CC[C@H](O)[C@H](N)C1 |r|
CCc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1CCC[C@H](N)C1 |r|
Cc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1CCC[C@H](N)C1 |r,wU:25.27,29.32,(6,5,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,;3.33,1.93,;4.67,2.69,;6,1.93,;3.33,.38,;2,-.38,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;.67,-2.69,;.67,-4.23,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-3.33,-5,;-4.67,-4.23,;-4.67,-2.69,;-3.33,-1.93,;-3.33,-.38,;-2,.38,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,)|
CCc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(C)c1F |r,wU:5.5,1.0,wD:7.8,(-.67,2.7,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;6,5,;4.67,2.69,;6,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1ccccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1nc(ccc1F)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(C)c1F |r,wU:6.8,3.3,1.0,(-.67,2.7,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;6,5,;4.67,2.69,;6,1.93,)|
Cc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1CCC[C@H](N)C1 |r|
Cc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@H]1C[C@@H](N)C[C@@H](N)C1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)ccc(C)c1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)ccc(C)c1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(O)cc1F |r,wU:5.7,1.0,(-6,1.93,;-4.67,1.15,;-3.33,1.93,;-2,1.15,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;4.67,1.93,;6,1.15,;4.67,3.47,;3.33,4.23,;3.33,5.78,;2,3.47,;2,1.93,;.67,1.15,)|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(O)ccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1cc(O)ccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1cc(O)ccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cc(O)cc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1ccc(O)cc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccc(O)cc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1ccc(O)cc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(C)c1F |r,wD:3.9,1.0,5.5,7.8,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-2.56,4.03,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;6,5,;4.67,2.69,;6,1.93,)|
Cc1ccc(F)c(c1F)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1CC[C@H](O)[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1c(F)cc(O)cc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1cc(O)ccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(C)c1F |r,wU:3.9,5.5,1.0,wD:7.8,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;6,5,;4.67,2.69,;6,1.93,)|
COc1ccc(F)c(c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(O)ccc1F |r|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:30.33,wD:26.28,28.31,32.35,(6.67,4.23,;5.33,5,;4,4.23,;2.67,5,;1.33,4.23,;1.33,2.69,;,1.93,;2.67,1.93,;4,2.69,;5.33,1.93,;2.67,.38,;1.33,-.38,;1.33,-1.93,;2.67,-2.69,;4,-1.93,;4,-.38,;5.33,.38,;,-2.69,;,-4.23,;-1.33,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-4,-5,;-5.33,-4.23,;-5.33,-2.69,;-4,-1.93,;-4,-.38,;-5.33,.38,;-5.33,1.93,;-6.67,2.69,;-4,2.69,;-4,4.23,;-2.67,1.93,;-1.33,2.69,;-2.67,.38,)|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1cc(F)cc(F)c1F |r|
CC1(C)C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:7.9,4.4,(-6,2.69,;-4.67,1.93,;-4.67,3.47,;-3.33,2.69,;-2,1.93,;-.67,2.69,;-2,.38,;-3.33,-.38,;-4.67,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.8,wD:3.9,1.0,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.7,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.38,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)[C@@H]1CC[C@H](O)CC1 |r,wU:5.7,23.25,1.0,26.29,(-6,1.93,;-4.67,1.15,;-3.33,1.93,;-2,1.15,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;4.67,1.93,;4.67,3.47,;3.33,4.23,;3.33,5.78,;2,3.47,;2,1.93,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)[C@@H]1CC[C@H](O)CC1 |r,wU:6.8,24.26,3.3,27.30,1.0,(-.67,1.93,;-2,1.15,;-3.33,1.93,;-4.67,1.15,;-6,1.93,;-4.67,-.38,;-3.33,-1.15,;-2,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;4.67,1.93,;4.67,3.47,;3.33,4.23,;3.33,5.78,;2,3.47,;2,1.93,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)[C@H]1CC[C@H](O)CC1 |r,wU:6.8,24.26,3.3,1.0,wD:27.30,(-.67,1.93,;-2,1.15,;-3.33,1.93,;-4.67,1.15,;-6,1.93,;-4.67,-.38,;-3.33,-1.15,;-2,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,)|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)[C@H]1CC[C@H](O)CC1 |r,wU:5.7,23.25,1.0,wD:26.29,(-6,1.93,;-4.67,1.15,;-3.33,1.93,;-2,1.15,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1cc(C)ccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(C)ccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cccc(F)c1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(F)ccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1ccccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cccc1F |r|
CCCOc1ccc(F)c(c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1CC[C@H](O)[C@H](N)C1 |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wD:3.8,1.0,6.7,(-1.33,2.69,;-2.67,1.93,;-2.67,.38,;-4,-.38,;-5.33,.38,;-5.33,1.93,;-4,2.69,;-3.23,4.03,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-4,-5,;-2.67,-4.23,;-2.67,-2.69,;-1.33,-1.93,;,-2.69,;,-4.23,;1.33,-1.93,;1.33,-.38,;2.67,.38,;4,-.38,;5.33,.38,;4,-1.93,;2.67,-2.69,;2.67,-4.23,;2.67,1.93,;1.33,2.69,;,1.93,;1.33,4.23,;2.67,5,;4,4.23,;4,2.69,;5.33,1.93,)|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1ccccc1F |r|
CCCOc1ccc(F)c(c1)-c1nc(C(=O)Nc2cnccc2[C@@H]2CC[C@H](O)[C@H](N)C2)c(N)cc1F |r|
CCCOc1ccc(F)c(c1)-c1ccc(N)c(n1)C(=O)Nc1cnccc1[C@@H]1CC[C@H](O)[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@H]1C[C@@H](N)C[C@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1c(F)cccc1F |r|
C[C@H]1C[C@@H](N)C[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(C)ccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1cc(C)ccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccc(F)cc1F |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cccc(F)c1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1nc(ccc1F)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(F)ccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccc(F)cc1F |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1ccccc1F |r|
CCCOc1ccc(F)c(c1)-c1cccc(n1)C(=O)Nc1cnccc1[C@@H]1CC[C@H](O)[C@H](N)C1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.9,5.5,7.8,1.0,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.9,1.0,7.8,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccccc1F |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.8,1.0,6.7,(-1.33,2.69,;-2.67,1.93,;-2.67,.38,;-4,-.38,;-5.33,.38,;-5.33,1.93,;-4,2.69,;-4,4.23,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-4,-5,;-2.67,-4.23,;-2.67,-2.69,;-1.33,-1.93,;,-2.69,;,-4.23,;1.33,-1.93,;2.67,-2.69,;4,-1.93,;4,-.38,;5.33,.38,;2.67,.38,;1.33,-.38,;2.67,1.93,;4,2.69,;5.33,1.93,;4,4.23,;2.67,5,;1.33,4.23,;1.33,2.69,;,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)C1CCCCC1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)C1CCCCC1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)C1CCCCC1 |r|
NC1C=C(CCC1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |c:2|
N[C@@H]1C=C(CC[C@@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r,c:2|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@@H](C[C@H](N)[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.8,wD:1.0,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@@H]1C[C@@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.7,1.0,(-6,2.69,;-4.67,1.93,;-3.33,2.69,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wD:5.7,1.0,(-1.33,2.69,;-2.67,1.93,;-4,2.69,;-5.33,1.93,;-5.33,.38,;-4,-.38,;-2.67,.38,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-4,-5,;-2.67,-4.23,;-2.67,-2.69,;-1.33,-1.93,;,-2.69,;,-4.23,;1.33,-1.93,;1.33,-.38,;2.67,.38,;4,-.38,;5.33,.38,;4,-1.93,;2.67,-2.69,;2.67,-4.23,;2.67,1.93,;4,2.69,;5.33,1.93,;4,4.23,;2.67,5,;1.33,4.23,;1.33,2.69,;,1.93,)|
CC(=O)O[C@H]1CC[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@@H]1CN(C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
N[C@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
CC1CC(O)C=C(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |c:5|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1nc(ccc1N)C1CCCCC1 |r|
NC1CCCC(=C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |c:5|
Cc1ccc(F)c(c1)-c1cccc(n1)C(=O)Nc1cnccc1[C@H]1C[C@@H](N)C[C@H](C1)C(F)(F)F |r|
COc1cc(F)c(c(F)c1)-c1cccc(n1)C(=O)Nc1cnccc1[C@H]1C[C@@H](N)C[C@H](C1)C(F)(F)F |r|
N[C@@H]1C[C@@H](C[C@@H](C1)C(F)(F)F)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wD:3.11,1.0,5.7,(,2.69,;-1.33,1.93,;-1.33,.38,;-2.67,-.38,;-4,.38,;-4,1.93,;-2.67,2.69,;-5.33,2.69,;-6.1,1.36,;-4.56,4.03,;-6.67,3.47,;-2.67,-1.93,;-4,-2.69,;-4,-4.23,;-2.67,-5,;-1.33,-4.23,;-1.33,-2.69,;,-1.93,;1.33,-2.69,;1.33,-4.23,;2.67,-1.93,;2.67,-.38,;4,.38,;5.33,-.38,;6.67,.38,;5.33,-1.93,;4,-2.69,;4,-4.23,;4,1.93,;5.33,2.69,;6.67,1.93,;5.33,4.23,;4,5,;2.67,4.23,;2.67,2.69,;1.33,1.93,)|
N[C@@H]1C[C@@H](C[C@@H](C1)C(F)(F)F)c1ccncc1NC(=O)c1ccc(F)c(n1)C1CCCCC1 |r|
N[C@@H]1C[C@@H](C[C@@H](C1)C(F)(F)F)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@@H]1CN(C[C@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,wD:7.8,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@H]1CN(C[C@@H](O)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccccc1F |r|
C[C@H]1CN(C[C@@H](O)[C@@H]1O)c1ccncc1NC(=O)c1cccc(n1)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](O)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.8,wD:1.0,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@H]1C[C@H](C[C@@H](O)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.8,wD:3.9,1.0,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cccnc1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccncc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccncc1 |r|
C[C@H]1C[C@H](C[C@@H](O)[C@@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:7.8,wD:3.9,1.0,5.5,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.39,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;4.67,2.69,;6,1.93,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.93,)|
CC1(C)C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(O)cc1F |r,wU:7.9,4.4,(-1,1.15,;-2,1.15,;-1.23,2.49,;-3.33,1.93,;-4.67,1.15,;-6,1.93,;-4.67,-.38,;-3.33,-1.15,;-2,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;4.67,1.93,;6,1.15,;4.67,3.47,;3.33,4.23,;3.33,5.78,;2,3.47,;2,1.93,;.67,1.15,)|
COc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@H]1C[C@@H](N)CC(C)(C)C1 |r,wU:26.28,28.31,(2,6.16,;3.33,5.39,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-2,.77,;-1,.77,;-1.23,2.1,;-2,-.77,)|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(O)c1F |r,wU:5.7,1.0,(-6,2.69,;-4.67,1.92,;-3.33,2.69,;-2,1.92,;-2,.38,;-3.33,-.39,;-4.67,.38,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;6,5.01,;4.67,2.69,;6,1.92,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(O)c1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.92,;-3.33,2.69,;-4.67,1.92,;-6,2.69,;-4.67,.38,;-3.33,-.39,;-2,.38,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;6,5.01,;4.67,2.69,;6,1.92,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cc(ccc1F)C(F)(F)F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1cccc(c1F)C(F)(F)F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(O)cc1F |r,wU:6.8,3.3,1.0,(-.67,1.93,;-2,1.15,;-3.33,1.93,;-4.67,1.15,;-6,1.93,;-4.67,-.38,;-3.33,-1.15,;-2,-.38,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)ccc(F)c1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;6,5,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.9,5.5,1.0,wD:7.8,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.38,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wD:3.8,1.0,6.7,(-1.33,2.69,;-2.67,1.93,;-2.67,.38,;-4,-.38,;-5.33,.38,;-5.33,1.93,;-4,2.69,;-4,4.23,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-4,-5,;-2.67,-4.23,;-2.67,-2.69,;-1.33,-1.93,;,-2.69,;,-4.23,;1.33,-1.93,;1.33,-.38,;2.67,.38,;4,-.38,;5.33,.38,;4,-1.93,;2.67,-2.69,;2.67,-4.23,;2.67,1.93,;1.33,2.69,;,1.93,;1.33,4.23,;2.67,5,;4,4.23,;4,2.69,;5.33,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wD:3.9,1.0,5.5,7.8,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.38,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:6.8,3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.38,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,wD:3.9,5.5,7.8,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.9,1.0,wD:5.5,7.8,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-.67,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1ccncc1F |r|
CC1CC(O)C=C(C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |c:5,(-6,2.69,;-4.67,1.93,;-3.33,2.69,;-2,1.93,;-.67,2.69,;-2,.38,;-3.33,-.38,;-4.67,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](C[C@@H](O)[C@H]1O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.9,5.5,7.8,wD:1.0,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1F)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,3.9,7.8,1.0,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
Cn1cc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cn1
N[C@H]1CCCN(C1)c1[nH]ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1NCC1CCNCC1
Cn1ncc(NC(=O)c2nc(sc2N)-c2ccccc2F)c1N1CCC[C@H](N)C1 |r|
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2)c1N1CCC(N)CC1
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2F)c1N1CCC[C@@H](N)C1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCCC(N)CC1
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2F)c1N1CCCC(N)CC1
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1OCC1CCNCC1
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2F)c1OC1CCNCC1
Cn1ncc(NC(=O)c2nc(cnc2N)-c2ccccc2F)c1N1CCC[C@H](N)C1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1OC1CCNCC1
Cn1ncc(NC(=O)c2nc(Br)cnc2N)c1N1CCC[C@H](N)C1 |r|
Cn1ncc(NC(=O)c2nc(cnc2N)-c2ccccc2F)c1N1CCC(N)CC1
Cn1ncc(NC(=O)c2nc(Cl)cnc2N)c1N1CCC[C@H](N)C1 |r|
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2F)c1N1CC[C@@H](N)C1 |r|
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2F)c1N1CCC[C@H](CN)C1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CC[C@H](CN)C1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCC[C@@H](N)CC1 |r|
Cn1ncc(NC(=O)c2nc(cnc2N)-c2ccccc2F)c1N1CCC[C@@H](N)CC1 |r|
Cn1ncc(NC(=O)c2nc(ccc2N)-c2ccccc2F)c1N1CCC[C@H](N)CC1 |r|
Cn1ncc(NC(=O)c2cncc(n2)-c2ccccc2F)c1N1CCC[C@H](N)CC1 |r|
CN1CCC(CC1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnn1C
Cn1ncc(NC(=O)c2ccc(F)c(n2)-c2c(F)cccc2F)c1N1CCC[C@@H](N)CC1 |r,wD:28.31,(-5.72,2.87,;-4.95,1.54,;-5.85,.29,;-4.95,-.96,;-3.48,-.48,;-2.15,-1.25,;-2.15,-2.79,;-3.48,-3.56,;-.82,-3.56,;-.82,-5.1,;.52,-5.87,;1.85,-5.1,;3.19,-5.87,;1.85,-3.56,;.52,-2.79,;3.19,-2.79,;3.19,-1.25,;1.85,-.48,;4.52,-.48,;5.85,-1.25,;5.85,-2.79,;4.52,-3.56,;4.52,-5.1,;-3.48,1.06,;-2.15,1.83,;-.76,1.16,;.63,1.83,;.97,3.33,;.01,4.54,;.78,5.87,;-1.53,4.54,;-2.49,3.33,)|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1C1CCNCC1
CN[C@H]1CCCN(CC1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnn1C |r|
Nc1sc(nc1C(=O)Nc1cnn(CCF)c1)-c1c(F)cccc1F
CCn1ncc(NC(=O)c2nc(sc2N)-c2ccccc2F)c1N1CCC[C@@H](N)CC1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1C1CCC(N)CC1 |(-5.88,3.66,;-5.11,2.33,;-6.01,1.08,;-5.11,-.17,;-3.64,.31,;-2.31,-.46,;-2.31,-2,;-3.64,-2.77,;-.98,-2.77,;.49,-2.29,;1.39,-3.54,;.49,-4.79,;-.98,-4.31,;-2.31,-5.08,;2.93,-3.54,;3.7,-2.21,;2.93,-.87,;5.24,-2.21,;6.01,-3.54,;5.24,-4.87,;3.7,-4.87,;2.93,-6.21,;-3.64,1.85,;-2.55,2.94,;-1.07,2.54,;.02,3.63,;-.38,5.12,;.71,6.21,;-1.86,5.52,;-2.95,4.43,)|
NC1CCCC(=C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |c:5|
N[C@@H]1CN(CC[C@@H]1O)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@H]1O)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
N[C@H]1C[C@@H](O)CN(C1)c1ccncc1Nc1cccc2ccc(nc12)-c1c(F)cccc1F |r|
N[C@H]1C[C@@H](CO)CN(C1)c1ccncc1Nc1cccc2ccc(nc12)-c1c(F)cccc1F |r|
CCO[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
N[C@@H]1CCCN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
NC1CC(N)CN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F
N[C@@H]1CN(CC[C@H]1F)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
N[C@H]1CN(CC[C@@H]1F)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
NC1CCCCN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F
N[C@H]1CCCN(C1)c1ncncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
N[C@H]1C[C@@H](CF)CN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
C[C@H]1C[C@@H](N)CN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
NC1CCCN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1nccs1
N[C@H]1CCCN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1ccccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1cccc2cnc(nc12)-c1cccc(c1)-c1nccs1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@H]1F)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1C[C@@H](O)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
COC1CCN(CC1N)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
CO[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1C[C@H](O)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1C[C@@H](CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F)OC(=O)c1ccccc1 |r|
N[C@H]1C[C@@H](F)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1csc(n1)C1CCCCC1 |r|
NC1CC(CO)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
CC1CC(N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
NC1CC(CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F)C(F)(F)F
NC1CC(CF)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
N[C@H]1C[C@H](F)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
NC1CN(CCC1Cl)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
CC1CCN(CC1N)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
CC1CC(N)CN(C1)c1ccncc1NC(=O)c1csc(n1)C1CCCCC1
NC1CC(CN(C1)c1ccncc1NC(=O)c1csc(n1)C1CCCCC1)C(F)(F)F
CO[C@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
CCO[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC(F)(F)C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
CC[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F)C(F)(F)F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
Nc1sc(nc1C(=O)Nc1cnccc1N1CCC(F)CC1)-c1c(F)cccc1F
C[C@@H]1C[C@H](O)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](O)C[C@@H](C1)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@@H]1CN(C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@@H]1C[C@@H](CC[C@@H]1O)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@@H]1C[C@@H](CC[C@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)C1CCCCC1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1C[C@H](C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1csc(n1)C1CCCCC1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
CC1(C)C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1csc(n1)-c1ccccc1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1csc(n1)-c1ccccc1F |r|
CC(C)NC(=O)c1ccc(F)c(c1)-c1nc(cs1)C(=O)Nc1cnccc1N1CCC[C@H](N)C1 |r|
COc1ccc(F)c(-c2nc(cs2)C(=O)Nc2cnccc2[C@@H]2C[C@H](C)C[C@H](N)C2)c1F |r|
CC(C)Oc1ccc(F)c(-c2nc(cs2)C(=O)Nc2cnccc2[C@@H]2C[C@H](C)C[C@H](N)C2)c1F |r|
CCOc1ccc(F)c(-c2nc(cs2)C(=O)Nc2cnccc2[C@@H]2C[C@H](C)C[C@H](N)C2)c1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)ccc(F)c1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)ccc(Cl)c1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cc(O)cc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1F)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
COc1cc(ccc1Nc1ncc2CCCc3c(nn(C)c3-c2n1)C(N)=O)N1CCN(C)CC1
COc1cc(ccc1Nc1ncc2CCCc3c(nn(C)c3-c2n1)C(=O)N[C@H](CN)c1ccccc1)C(=O)NC1CCN(C)CC1 |r|
CN1CCN(CC1)c1ccc(Nc2ncc3CCCc4c(nn(C)c4-c3n2)C(N)=O)cc1
Cn1cc(C(N)=O)c2CCc3cnc(N)nc3-c12
NC(=O)c1c([nH]c2c1ccc1cnc(N)nc21)-c1ccccc1
Cn1c(c(C(N)=O)c2CCc3cnc(N)nc3-c12)-c1ccccc1
Cn1c(c(C(N)=O)c2ccc3cnc(N)nc3c12)-c1ccccc1
CCc1cccc(CC)c1NC(=O)c1c(C)n(C)c-2c1CCc1cnc(Nc3ccc(cc3OC)N3CCC(CC3)N3CCCC3)nc-21
COc1cc(ccc1Nc1ncc2CCc3c(C(N)=O)c(C)n(C)c3-c2n1)N1CCN(C)CC1
CSc1ncc2CCc3c(cn(C(C)C)c3-c2n1)C(N)=O
CSc1ncc2CCc3c(cn(CCO)c3-c2n1)C(N)=O
CSc1ncc2ccc3c(C(N)=O)c(C)n(CCO)c3c2n1
CSc1ncc2ccc3c(C(N)=O)c(C)n(C(C)C)c3c2n1
CSc1ncc2CCc3c(cn(C4CCNCC4)c3-c2n1)C(N)=O
CSc1ncc2CCc3c(cn([C@@H]4CC[C@H](N)CC4)c3-c2n1)C(N)=O |wU:15.15,12.11,(6.59,1.87,;5.05,1.92,;4.24,.61,;4.97,-.75,;4.16,-2.06,;2.62,-2.01,;1.81,-3.32,;.27,-3.27,;-.46,-1.92,;-1.96,-1.55,;-2.07,-.01,;-.64,.57,;-.28,2.07,;1.2,2.49,;1.57,3.99,;.46,5.06,;.82,6.55,;-1.02,4.63,;-1.39,3.13,;.35,-.61,;1.89,-.65,;2.7,.65,;-3.13,-2.54,;-2.86,-4.06,;-4.58,-2.02,)|
CSc1ncc2ccc3c(cn([C@@H]4CC[C@H](N)CC4)c3c2n1)C(N)=O |wU:15.15,12.11,(6.59,1.87,;5.05,1.92,;4.24,.61,;4.97,-.75,;4.16,-2.06,;2.62,-2.01,;1.81,-3.32,;.27,-3.27,;-.46,-1.92,;-1.96,-1.55,;-2.07,-.01,;-.64,.57,;-.28,2.07,;1.2,2.49,;1.57,3.99,;.46,5.06,;.82,6.55,;-1.02,4.63,;-1.39,3.13,;.35,-.61,;1.89,-.65,;2.7,.65,;-3.13,-2.54,;-2.86,-4.06,;-4.58,-2.02,)|
CSc1ncc2ccc3c(cn(C4CCNCC4)c3c2n1)C(N)=O
CSc1ncc2ccc3c(c[nH]c3c2n1)C(N)=O
CSc1ncc2ccc3c(cn(CC(C)(C)CN)c3c2n1)C(N)=O
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.14,1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
COCC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:10.14,7.7,12.13,6.5,(.67,5.78,;.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
CC(C)C(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:10.14,7.7,12.13,6.5,(.67,4.24,;-.67,3.47,;.42,2.38,;-2,4.24,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1cc(nn1)-c1ccsc1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.22,.04,;-1.56,-.73,;-1.56,-2.27,;-2.89,-3.04,;-4.22,-2.27,;-4.22,-.73,;-5.56,.04,;-2.89,.04,;-2.89,1.58,;-4.14,2.49,;-3.66,3.95,;-2.12,3.95,;-1.64,2.49,;-4.43,5.29,;-3.95,6.75,;-5.2,7.66,;-6.45,6.75,;-5.97,5.29,;-2.89,-4.58,;-4.22,-5.35,;-4.22,-6.89,;-2.89,-7.66,;-1.56,-6.89,;-1.56,-5.35,;-.22,-4.58,;1.11,-5.35,;1.11,-6.89,;2.44,-4.58,;3.78,-5.35,;5.11,-4.58,;5.11,-3.04,;6.45,-2.27,;3.78,-2.27,;2.44,-3.04,;3.78,-.73,;2.44,.04,;1.11,-.73,;2.44,1.58,;3.78,2.35,;5.11,1.58,;5.11,.04,;6.45,-.73,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
C[C@H]1C[C@H](C[C@@H](N)\C1=N/O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.10,1.0,5.5,(-.67,2.7,;-2,1.93,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.93,;-6,2.7,;-3.33,2.7,;-3.33,4.24,;-4.67,5.01,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.7,;.67,1.93,;2,4.24,;3.33,5,;4.67,4.24,;4.67,2.7,;6,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1cc(C)nn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.67,1.23,;-2,.46,;-2,-1.08,;-3.33,-1.85,;-4.67,-1.08,;-4.67,.46,;-6,1.23,;-3.33,1.23,;-3.33,2.77,;-4.58,3.67,;-4.1,5.14,;-4.87,6.47,;-2.56,5.14,;-2.09,3.67,;-3.33,-3.39,;-4.67,-4.16,;-4.67,-5.7,;-3.33,-6.47,;-2,-5.7,;-2,-4.16,;-.67,-3.39,;.67,-4.16,;.67,-5.7,;2,-3.39,;3.33,-4.16,;4.67,-3.39,;4.67,-1.85,;6,-1.08,;3.33,-1.08,;2,-1.85,;3.33,.46,;2,1.23,;.67,.46,;2,2.77,;3.33,3.54,;4.67,2.77,;4.67,1.23,;6,.46,)|
CCOC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:10.14,7.7,12.13,6.5,(.67,5.78,;.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
CC(C)OC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:11.15,8.8,13.14,7.6,(.67,5.78,;.67,4.24,;1.58,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:9.13,6.6,11.12,5.4,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@H]1C[C@H](C[C@@H](N)C1=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.9,1.0,5.5,(-.67,2.7,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.7,;-3.33,2.7,;-3.33,4.24,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.7,;.67,1.93,;2,4.24,;3.33,5,;4.67,4.24,;4.67,2.7,;6,1.93,)|
CO\N=C1/[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.11,4.4,9.10,(-2,5.78,;-2,4.24,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
CO\N=C1\[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.11,4.4,9.10,(-4.67,5.78,;-4.67,4.24,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
COCc1cn(nn1)[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:9.10,14.16,8.8,(-4.87,7.81,;-4.1,6.47,;-4.87,5.14,;-4.1,3.8,;-4.58,2.34,;-3.33,1.43,;-2.09,2.34,;-2.56,3.8,;-3.33,-.11,;-2,-.88,;-.67,-.11,;-2,-2.42,;-3.33,-3.19,;-4.67,-2.42,;-4.67,-.88,;-6,-.11,;-3.33,-4.73,;-4.67,-5.5,;-4.67,-7.04,;-3.33,-7.81,;-2,-7.04,;-2,-5.5,;-.67,-4.73,;.67,-5.5,;.67,-7.04,;2,-4.73,;3.33,-5.5,;4.67,-4.73,;4.67,-3.19,;6,-2.42,;3.33,-2.42,;2,-3.19,;3.33,-.88,;2,-.11,;.67,-.88,;2,1.43,;3.33,2.2,;4.67,1.43,;4.67,-.11,;6,-.88,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(=O)(=O)CCO)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.14,1.0,5.5,7.8,(,2.41,;-1.33,1.64,;-1.33,.1,;-2.67,-.67,;-4,.1,;-4,1.64,;-5.33,2.41,;-2.67,2.41,;-2.67,3.95,;-1.13,3.95,;-1.9,5.29,;-4,4.72,;-5.33,3.95,;-6.67,4.72,;-2.67,-2.21,;-4,-2.98,;-4,-4.52,;-2.67,-5.29,;-1.33,-4.52,;-1.33,-2.98,;,-2.21,;1.33,-2.98,;1.33,-4.52,;2.67,-2.21,;4,-2.98,;5.33,-2.21,;5.33,-.67,;6.67,.1,;4,.1,;2.67,-.67,;4,1.64,;2.67,2.41,;1.33,1.64,;2.67,3.95,;4,4.72,;5.33,3.95,;5.33,2.41,;6.67,1.64,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@H]1NS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.8,wD:3.13,1.0,5.5,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,5.11,;-2.77,5.67,;-1.23,3,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1NS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,wD:7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,5.11,;-2.77,5.67,;-1.23,3,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1CN(C[C@@H](N)[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.67,2.7,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.7,;-3.33,2.7,;-3.33,4.24,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.7,;.67,1.93,;2,4.24,;3.33,5,;4.67,4.24,;4.67,2.7,;6,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@H]1NS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,3.57,;-2.77,5.67,;-1.23,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
COCCS(=O)(=O)[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:11.15,8.8,13.14,7.6,(.67,5.78,;.67,4.24,;-.67,3.47,;-2,4.24,;-3.33,3.47,;-4.87,3.47,;-4.1,4.8,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@H]1CN(C[C@@H](N)[C@H]1NC(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.67,1.93,;-2,1.16,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-2,4.24,;-.67,3.47,;-2,5.78,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
COC(=O)N[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:9.13,6.6,11.12,5.4,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1NC(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.12,1.0,5.5,7.8,(-.67,1.93,;-2,1.16,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-2,4.24,;-.67,3.47,;-2,5.78,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1NC(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.12,1.0,5.5,7.8,(-.67,1.93,;-2,1.16,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-2,4.24,;-.67,3.47,;-2,5.78,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1NS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.13,1.0,5.5,7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,3.57,;-2.77,5.67,;-1.23,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1NS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,3.57,;-2.77,5.67,;-1.23,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1N=[N+]=[N-])c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.11,1.0,5.5,7.8,(-.67,2.31,;-2,1.54,;-2,,;-3.33,-.77,;-4.67,,;-4.67,1.54,;-6,2.31,;-3.33,2.31,;-3.33,3.85,;-2,4.62,;-.67,5.39,;-3.33,-2.31,;-4.67,-3.08,;-4.67,-4.62,;-3.33,-5.39,;-2,-4.62,;-2,-3.08,;-.67,-2.31,;.67,-3.08,;.67,-4.62,;2,-2.31,;3.33,-3.08,;4.67,-2.31,;4.67,-.77,;6,,;3.33,,;2,-.77,;3.33,1.54,;2,2.31,;.67,1.54,;2,3.85,;3.33,4.62,;4.67,3.85,;4.67,2.31,;6,1.54,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1N=[N+]=[N-])c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.11,1.0,5.5,7.8,(-.67,2.31,;-2,1.54,;-2,,;-3.33,-.77,;-4.67,,;-4.67,1.54,;-6,2.31,;-3.33,2.31,;-3.33,3.85,;-2,4.62,;-.67,5.39,;-3.33,-2.31,;-4.67,-3.08,;-4.67,-4.62,;-3.33,-5.39,;-2,-4.62,;-2,-3.08,;-.67,-2.31,;.67,-3.08,;.67,-4.62,;2,-2.31,;3.33,-3.08,;4.67,-2.31,;4.67,-.77,;6,,;3.33,,;2,-.77,;3.33,1.54,;2,2.31,;.67,1.54,;2,3.85,;3.33,4.62,;4.67,3.85,;4.67,2.31,;6,1.54,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1NC(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.12,1.0,5.5,wD:7.8,(-.67,1.93,;-2,1.16,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-2,4.24,;-.67,3.47,;-2,5.78,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1[S@@](C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.11,1.0,5.5,wD:7.8,8.9,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-2,5.01,;-4.67,5,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1[S@](C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.11,1.0,5.5,8.9,wD:7.8,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-2,5.01,;-4.67,5,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
CS[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.10,3.3,8.9,2.1,(-2,5.01,;-3.33,4.23,;-3.33,2.69,;-2,1.93,;-.67,2.69,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.12,1.0,5.5,wD:7.8,(-.67,2.41,;-2,1.64,;-2,.1,;-3.33,-.67,;-4.67,.1,;-4.67,1.64,;-6,2.41,;-3.33,2.41,;-3.33,3.95,;-2,4.72,;-4.87,3.95,;-4.1,5.29,;-3.33,-2.21,;-4.67,-2.98,;-4.67,-4.52,;-3.33,-5.29,;-2,-4.52,;-2,-2.98,;-.67,-2.21,;.67,-2.98,;.67,-4.52,;2,-2.21,;3.33,-2.98,;4.67,-2.21,;4.67,-.67,;6,.1,;3.33,.1,;2,-.67,;3.33,1.64,;2,2.41,;.67,1.64,;2,3.95,;3.33,4.72,;4.67,3.95,;4.67,2.41,;6,1.64,)|
CS[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.10,3.3,8.9,wD:2.1,(-2,5.01,;-3.33,4.23,;-3.33,2.69,;-2,1.93,;-.67,2.69,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.11,1.0,5.5,7.8,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-2,5.01,;-4.67,5,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.24,;-3.33,-5.01,;-2,-4.24,;-2,-2.7,;-.67,-1.93,;.67,-2.7,;.67,-4.24,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.12,1.0,5.5,7.8,(-.67,2.41,;-2,1.64,;-2,.1,;-3.33,-.67,;-4.67,.1,;-4.67,1.64,;-6,2.41,;-3.33,2.41,;-3.33,3.95,;-2,4.72,;-4.87,3.95,;-4.1,5.29,;-3.33,-2.21,;-4.67,-2.98,;-4.67,-4.52,;-3.33,-5.29,;-2,-4.52,;-2,-2.98,;-.67,-2.21,;.67,-2.98,;.67,-4.52,;2,-2.21,;3.33,-2.98,;4.67,-2.21,;4.67,-.67,;6,.1,;3.33,.1,;2,-.67,;3.33,1.64,;2,2.41,;.67,1.64,;2,3.95,;3.33,4.72,;4.67,3.95,;4.67,2.41,;6,1.64,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1OP(C)(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,wD:7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-1.23,5.67,;-.67,3.57,;-2.77,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OP(C)(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-1.23,5.67,;-.67,3.57,;-2.77,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,3.57,;-1.23,5.67,;-2.77,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1OS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,wD:7.8,(-.67,2.03,;-2,1.26,;-2,-.28,;-3.33,-1.05,;-4.67,-.28,;-4.67,1.26,;-6,2.03,;-3.33,2.03,;-3.33,3.57,;-2,4.34,;-.67,3.57,;-1.23,5.67,;-2.77,5.67,;-3.33,-2.59,;-4.67,-3.36,;-4.67,-4.9,;-3.33,-5.67,;-2,-4.9,;-2,-3.36,;-.67,-2.59,;.67,-3.36,;.67,-4.9,;2,-2.59,;3.33,-3.36,;4.67,-2.59,;4.67,-1.05,;6,-.28,;3.33,-.28,;2,-1.05,;3.33,1.26,;2,2.03,;.67,1.26,;2,3.57,;3.33,4.34,;4.67,3.57,;4.67,2.03,;6,1.26,)|
C[C@H]1C[C@H](C[C@@H](N)C11OCCO1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,(-.67,2.67,;-2,1.9,;-2,.36,;-3.33,-.41,;-4.67,.36,;-4.67,1.9,;-6,2.67,;-3.33,2.67,;-2.09,3.57,;-2.56,5.03,;-4.1,5.03,;-4.58,3.57,;-3.33,-1.95,;-4.67,-2.72,;-4.67,-4.26,;-3.33,-5.03,;-2,-4.26,;-2,-2.72,;-.67,-1.95,;.67,-2.72,;.67,-4.26,;2,-1.95,;3.33,-2.72,;4.67,-1.95,;4.67,-.41,;6,.36,;3.33,.36,;2,-.41,;3.33,1.9,;2,2.67,;.67,1.9,;2,4.21,;3.33,4.98,;4.67,4.21,;4.67,2.67,;6,1.9,)|
C[C@@H]1C[C@@H](C[C@H](N)C11OCCO1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.13,1.0,5.5,(-.67,2.67,;-2,1.9,;-2,.36,;-3.33,-.41,;-4.67,.36,;-4.67,1.9,;-6,2.67,;-3.33,2.67,;-2.09,3.57,;-2.56,5.03,;-4.1,5.03,;-4.58,3.57,;-3.33,-1.95,;-4.67,-2.72,;-4.67,-4.26,;-3.33,-5.03,;-2,-4.26,;-2,-2.72,;-.67,-1.95,;.67,-2.72,;.67,-4.26,;2,-1.95,;3.33,-2.72,;4.67,-1.95,;4.67,-.41,;6,.36,;3.33,.36,;2,-.41,;3.33,1.9,;2,2.67,;.67,1.9,;2,4.21,;3.33,4.98,;4.67,4.21,;4.67,2.67,;6,1.9,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1OCCC(O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.14,1.0,5.5,wD:7.8,(-.67,.77,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,5.39,;.67,4.62,;-.67,6.93,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;.67,-6.16,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;4.67,2.31,;4.67,.77,;6,,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@H]1OCCC(O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.8,wD:3.14,1.0,5.5,(-.67,.77,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,.77,;-3.33,2.31,;-2,3.08,;-2,4.62,;-.67,5.39,;.67,4.62,;-.67,6.93,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;.67,-6.16,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;4.67,2.31,;4.67,.77,;6,,)|
COC(=O)N(C)[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
COC(=O)N(C)[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1n1cncn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.14,1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1cncn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.14,1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccnc(n1)-c1c(F)cccc1F |r|
COC(=O)N(C)[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wD:10.14,7.7,12.13,6.5,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-4.67,4.24,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;3.33,5.77,;4.67,3.47,;4.67,1.93,;6,1.16,)|
COC(=O)N(C)[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:10.14,7.7,12.13,6.5,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.47,;-4.67,4.24,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.39,;-3.33,-1.16,;-4.67,-.39,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.47,;4.67,-2.7,;4.67,-1.16,;6,-.39,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.93,;.67,1.16,;2,3.47,;3.33,4.23,;3.33,5.77,;4.67,3.47,;4.67,1.93,;6,1.16,)|
C[C@H]1CN(C[C@@H](N)[C@H]1C#N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@H]1C#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:5.5,1.0,7.8,(-.67,1.93,;-2,1.16,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-3.33,5,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1cncn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
C[C@H]1CN(C[C@@H](N)[C@H]1C#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,(-.67,2.31,;-2,1.54,;-2,,;-3.33,-.77,;-4.67,,;-4.67,1.54,;-6,2.31,;-3.33,2.31,;-3.33,3.85,;-3.33,5.39,;-3.33,-2.31,;-4.67,-3.08,;-4.67,-4.62,;-3.33,-5.39,;-2,-4.62,;-2,-3.08,;-.67,-2.31,;.67,-3.08,;.67,-4.62,;2,-2.31,;3.33,-3.08,;4.67,-2.31,;4.67,-.77,;6,,;3.33,,;2,-.77,;3.33,1.54,;2,2.31,;.67,1.54,;2,3.85,;3.33,4.62,;4.67,3.85,;4.67,2.31,;6,1.54,)|
COC(=O)N(C)[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:12.13,7.7,6.5,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.46,;-4.67,4.23,;-3.33,1.92,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.16,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.46,;4.67,-2.7,;4.67,-1.16,;6,-.38,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.92,;.67,1.15,;2,3.46,;3.33,4.23,;3.33,5.77,;4.67,3.46,;4.67,1.92,;6,1.15,)|
COC(=O)N(C)[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:10.14,12.13,7.7,6.5,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.46,;-4.67,4.23,;-3.33,1.92,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.16,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.46,;4.67,-2.7,;4.67,-1.16,;6,-.38,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.92,;.67,1.15,;2,3.46,;3.33,4.23,;4.67,3.46,;4.67,1.92,;6,1.15,)|
COC(=O)N(C)[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:10.14,12.13,7.7,6.5,(.67,4.24,;-.67,3.47,;-2,4.24,;-2,5.78,;-3.33,3.46,;-4.67,4.23,;-3.33,1.92,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.16,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.46,;4.67,-2.7,;4.67,-1.16,;6,-.38,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.92,;.67,1.15,;2,3.46,;3.33,4.23,;4.67,3.46,;4.67,1.92,;6,1.15,)|
COC(=O)N(C)[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:12.13,7.7,6.5,(-6.67,4.23,;-5.33,3.47,;-4,4.23,;-4,5.78,;-2.67,3.47,;-1.33,4.24,;-2.67,1.93,;-1.33,1.16,;,1.93,;-1.33,-.38,;-2.67,-1.15,;-4,-.38,;-4,1.16,;-5.33,1.93,;-2.67,-2.69,;-4,-3.47,;-4,-5,;-2.67,-5.78,;-1.33,-5,;-1.33,-3.47,;,-2.69,;1.33,-3.47,;1.33,-5,;2.67,-2.69,;4,-3.46,;5.33,-2.69,;5.33,-1.15,;6.67,-.38,;4,-.38,;2.67,-1.15,;4,1.15,;2.67,1.93,;1.33,1.15,;2.67,3.47,;4,4.23,;5.33,3.47,;5.33,1.93,;6.67,1.15,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:6.10,8.9,3.3,wD:2.1,(-2,4.24,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1OCCC#N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@H]1N(C)C(C)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,(-.67,1.93,;-2,1.16,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-2,4.24,;-4.67,4.23,;-6,3.47,;-4.67,5.78,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1cc(CO)nn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,(-.67,.56,;-2,-.21,;-2,-1.75,;-3.33,-2.52,;-4.67,-1.75,;-4.67,-.21,;-6,.56,;-3.33,.56,;-3.33,2.1,;-2.09,3.01,;-2.56,4.47,;-1.79,5.8,;-2.56,7.14,;-4.1,4.47,;-4.58,3.01,;-3.33,-4.06,;-4.67,-4.83,;-4.67,-6.37,;-3.33,-7.14,;-2,-6.37,;-2,-4.83,;-.67,-4.06,;.67,-4.83,;.67,-6.37,;2,-4.06,;3.33,-4.83,;4.67,-4.06,;4.67,-2.52,;6,-1.75,;3.33,-1.75,;2,-2.52,;3.33,-.21,;2,.56,;.67,-.21,;2,2.1,;3.33,2.87,;4.67,2.1,;4.67,.56,;6,-.21,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1C#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.10,5.5,1.0,7.8,(-.67,2.31,;-2,1.54,;-2,,;-3.33,-.77,;-4.67,,;-4.67,1.54,;-6,2.31,;-3.33,2.31,;-3.33,3.85,;-3.33,5.39,;-3.33,-2.31,;-4.67,-3.08,;-4.67,-4.62,;-3.33,-5.39,;-2,-4.62,;-2,-3.08,;-.67,-2.31,;.67,-3.08,;.67,-4.62,;2,-2.31,;3.33,-3.08,;4.67,-2.31,;4.67,-.77,;6,,;3.33,,;2,-.77,;3.33,1.54,;2,2.31,;.67,1.54,;2,3.85,;3.33,4.62,;4.67,3.85,;4.67,2.31,;6,1.54,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1C#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.10,5.5,1.0,7.8,(-.67,2.31,;-2,1.54,;-2,,;-3.33,-.77,;-4.67,,;-4.67,1.54,;-6,2.31,;-3.33,2.31,;-3.33,3.85,;-3.33,5.39,;-3.33,-2.31,;-4.67,-3.08,;-4.67,-4.62,;-3.33,-5.39,;-2,-4.62,;-2,-3.08,;-.67,-2.31,;.67,-3.08,;.67,-4.62,;2,-2.31,;3.33,-3.08,;4.67,-2.31,;4.67,-.77,;6,,;3.33,,;2,-.77,;3.33,1.54,;2,2.31,;.67,1.54,;2,3.85,;3.33,4.62,;4.67,3.85,;4.67,2.31,;6,1.54,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(ncc1N)-c1c(F)cccc1F |r|
CCO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:3.15,5.5,1.0,7.8,(-.67,.87,;-2,.1,;-2,-1.44,;-3.33,-2.21,;-4.67,-1.44,;-4.67,.1,;-6,.87,;-3.33,.87,;-3.33,2.41,;-2,3.18,;-2,4.72,;-.67,5.49,;.67,6.26,;-1.44,6.83,;.1,4.16,;-3.33,-3.75,;-4.67,-4.52,;-4.67,-6.06,;-3.33,-6.83,;-2,-6.06,;-2,-4.52,;-.67,-3.75,;.67,-4.52,;.67,-6.06,;2,-3.75,;3.33,-4.52,;4.67,-3.75,;4.67,-2.21,;6,-1.44,;3.33,-1.44,;2,-2.21,;3.33,.1,;2,.87,;.67,.1,;2,2.41,;3.33,3.18,;3.33,4.72,;4.67,2.41,;4.67,.87,;6,.1,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wD:3.15,5.5,1.0,7.8,(-.67,.87,;-2,.1,;-2,-1.44,;-3.33,-2.21,;-4.67,-1.44,;-4.67,.1,;-6,.87,;-3.33,.87,;-3.33,2.41,;-2,3.18,;-2,4.72,;-.67,5.49,;.67,6.26,;-1.44,6.83,;.1,4.16,;-3.33,-3.75,;-4.67,-4.52,;-4.67,-6.06,;-3.33,-6.83,;-2,-6.06,;-2,-4.52,;-.67,-3.75,;.67,-4.52,;.67,-6.06,;2,-3.75,;3.33,-4.52,;4.67,-3.75,;4.67,-2.21,;6,-1.44,;3.33,-1.44,;2,-2.21,;3.33,.1,;2,.87,;.67,.1,;2,2.41,;3.33,3.18,;3.33,4.72,;4.67,2.41,;4.67,.87,;6,.1,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.10,8.9,3.3,wD:2.1,(-4.67,5,;-3.33,4.23,;-3.33,2.69,;-2,1.93,;-.67,2.7,;-2,.39,;-3.33,-.38,;-4.67,.39,;-4.67,1.93,;-6,2.7,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
CO[C@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:2.1,wD:6.10,8.9,3.3,(-4.67,5,;-3.33,4.23,;-3.33,2.69,;-2,1.93,;-.67,2.7,;-2,.39,;-3.33,-.38,;-4.67,.39,;-4.67,1.93,;-6,2.7,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.15,5.5,1.0,7.8,(-.67,.87,;-2,.1,;-2,-1.44,;-3.33,-2.21,;-4.67,-1.44,;-4.67,.1,;-6,.87,;-3.33,.87,;-3.33,2.41,;-2,3.18,;-2,4.72,;-.67,5.49,;.67,6.26,;-1.44,6.83,;.1,4.16,;-3.33,-3.75,;-4.67,-4.52,;-4.67,-6.06,;-3.33,-6.83,;-2,-6.06,;-2,-4.52,;-.67,-3.75,;.67,-4.52,;.67,-6.06,;2,-3.75,;3.33,-4.52,;4.67,-3.75,;4.67,-2.21,;6,-1.44,;3.33,-1.44,;2,-2.21,;3.33,.1,;2,.87,;.67,.1,;2,2.41,;3.33,3.18,;4.67,2.41,;4.67,.87,;6,.1,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.15,5.5,1.0,7.8,(-.67,.87,;-2,.1,;-2,-1.44,;-3.33,-2.21,;-4.67,-1.44,;-4.67,.1,;-6,.87,;-3.33,.87,;-3.33,2.41,;-2,3.18,;-2,4.72,;-.67,5.49,;.67,6.26,;-1.44,6.83,;.1,4.16,;-3.33,-3.75,;-4.67,-4.52,;-4.67,-6.06,;-3.33,-6.83,;-2,-6.06,;-2,-4.52,;-.67,-3.75,;.67,-4.52,;.67,-6.06,;2,-3.75,;3.33,-4.52,;4.67,-3.75,;4.67,-2.21,;6,-1.44,;3.33,-1.44,;2,-2.21,;3.33,.1,;2,.87,;.67,.1,;2,2.41,;3.33,3.18,;4.67,2.41,;4.67,.87,;6,.1,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(ncc1N)-c1c(F)cccc1F |r|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:11.12,6.6,5.4,(-6.67,4.23,;-5.33,3.47,;-4,4.23,;-4,5.78,;-2.67,3.47,;-2.67,1.93,;-1.33,1.16,;,1.93,;-1.33,-.38,;-2.67,-1.15,;-4,-.38,;-4,1.16,;-5.33,1.93,;-2.67,-2.69,;-4,-3.47,;-4,-5,;-2.67,-5.78,;-1.33,-5,;-1.33,-3.47,;,-2.69,;1.33,-3.47,;1.33,-5,;2.67,-2.69,;4,-3.46,;5.33,-2.69,;5.33,-1.15,;6.67,-.38,;4,-.38,;2.67,-1.15,;4,1.15,;2.67,1.93,;1.33,1.15,;2.67,3.47,;4,4.23,;4,5.78,;5.33,3.47,;5.33,1.93,;6.67,1.15,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:11.12,6.6,5.4,(-6.67,4.23,;-5.33,3.47,;-4,4.23,;-4,5.78,;-2.67,3.47,;-2.67,1.93,;-1.33,1.16,;,1.93,;-1.33,-.38,;-2.67,-1.15,;-4,-.38,;-4,1.16,;-5.33,1.93,;-2.67,-2.69,;-4,-3.47,;-4,-5,;-2.67,-5.78,;-1.33,-5,;-1.33,-3.47,;,-2.69,;1.33,-3.47,;1.33,-5,;2.67,-2.69,;4,-3.46,;5.33,-2.69,;5.33,-1.15,;6.67,-.38,;4,-.38,;2.67,-1.15,;4,1.15,;2.67,1.93,;1.33,1.15,;2.67,3.47,;4,4.23,;5.33,3.47,;5.33,1.93,;6.67,1.15,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:3.13,5.5,1.0,7.8,(-.67,1.16,;-2,.39,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.39,;-6,1.16,;-3.33,1.15,;-3.33,2.69,;-2,3.47,;-2,5,;-.67,5.78,;.67,6.54,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;3.33,5,;4.67,2.69,;4.67,1.15,;6,.38,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wD:3.13,5.5,1.0,7.8,(-.67,1.16,;-2,.39,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.39,;-6,1.16,;-3.33,1.15,;-3.33,2.69,;-2,3.47,;-2,5,;-.67,5.78,;.67,6.54,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;3.33,5,;4.67,2.69,;4.67,1.15,;6,.38,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,5.5,1.0,7.8,(-.67,1.16,;-2,.39,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.39,;-6,1.16,;-3.33,1.15,;-3.33,2.69,;-2,3.47,;-2,5,;-.67,5.78,;.67,6.54,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;4.67,2.69,;4.67,1.15,;6,.38,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.13,5.5,1.0,7.8,(-.67,1.16,;-2,.39,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.39,;-6,1.16,;-3.33,1.15,;-3.33,2.69,;-2,3.47,;-2,5,;-.67,5.78,;.67,6.54,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;4.67,2.69,;4.67,1.15,;6,.38,)|
C[C@H]1CN(C[C@@H](N)[C@H]1N=[N+]=[N-])c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,(-.67,2.31,;-2,1.54,;-2,,;-3.33,-.77,;-4.67,,;-4.67,1.54,;-6,2.31,;-3.33,2.31,;-3.33,3.85,;-2,4.62,;-.67,5.39,;-3.33,-2.31,;-4.67,-3.08,;-4.67,-4.62,;-3.33,-5.39,;-2,-4.62,;-2,-3.08,;-.67,-2.31,;.67,-3.08,;.67,-4.62,;2,-2.31,;3.33,-3.08,;4.67,-2.31,;4.67,-.77,;6,,;3.33,,;2,-.77,;3.33,1.54,;2,2.31,;.67,1.54,;2,3.85,;3.33,4.62,;4.67,3.85,;4.67,2.31,;6,1.54,)|
CCO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.11,9.10,4.4,3.2,(-4.67,5.78,;-4.67,4.24,;-3.33,3.46,;-3.33,1.92,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.16,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.7,;-4.67,-3.47,;-4.67,-5.01,;-3.33,-5.78,;-2,-5.01,;-2,-3.47,;-.67,-2.7,;.67,-3.47,;.67,-5.01,;2,-2.7,;3.33,-3.46,;4.67,-2.7,;4.67,-1.16,;6,-.38,;3.33,-.39,;2,-1.16,;3.33,1.15,;2,1.92,;.67,1.15,;2,3.46,;3.33,4.23,;4.67,3.46,;4.67,1.92,;6,1.15,)|
CCO[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wD:7.11,9.10,4.4,3.2,(-2,5.78,;-2,4.23,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
CCO[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:7.11,9.10,4.4,3.2,(-2,5.78,;-2,4.23,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.15,)|
CCO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:7.11,9.10,4.4,3.2,(-2,5.78,;-2,4.23,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.10,8.9,3.3,2.1,(-2,5,;-3.33,4.23,;-3.33,2.69,;-2,1.93,;-.67,2.7,;-2,.39,;-3.33,-.38,;-4.67,.39,;-4.67,1.93,;-6,2.7,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OC)[C@H](N)C1 |r,wU:29.31,36.39,31.34,33.36,(7.34,5.39,;6,6.16,;4.67,5.39,;3.33,6.16,;2,5.39,;2,3.85,;.67,3.08,;.67,1.54,;-.67,.77,;2,.77,;3.33,1.54,;4.67,.77,;3.33,3.08,;2,-.77,;.67,-1.54,;.67,-3.08,;2,-3.85,;3.33,-3.08,;3.33,-1.54,;4.67,-.77,;-.67,-3.85,;-.67,-5.39,;-2,-3.08,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-6,-5.39,;-6,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-3.33,-.77,;-3.33,.77,;-2,1.54,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-6,.77,;-7.34,1.54,;-6,-.77,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1CCS(=O)(=O)CC1 |r,wU:6.10,8.9,3.3,2.1,(-2,2.03,;-3.33,1.26,;-3.33,-.28,;-2,-1.05,;-.67,-.28,;-2,-2.59,;-3.33,-3.36,;-4.67,-2.59,;-4.67,-1.05,;-6,-.28,;-3.33,-4.9,;-4.67,-5.67,;-4.67,-7.21,;-3.33,-7.98,;-2,-7.21,;-2,-5.67,;-.67,-4.9,;.67,-5.67,;.67,-7.21,;2,-4.9,;3.33,-5.67,;4.67,-4.9,;4.67,-3.36,;6,-2.59,;3.33,-2.59,;2,-3.36,;3.33,-1.05,;2,-.28,;.67,-1.05,;2,1.26,;3.33,2.03,;4.67,1.26,;4.67,-.28,;6,-1.05,;3.33,3.57,;4.67,4.34,;4.67,5.88,;3.33,6.65,;2.56,7.98,;4.1,7.98,;2,5.88,;2,4.34,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)C |r,wU:6.10,8.9,3.3,2.1,(-2,3.85,;-3.33,3.08,;-3.33,1.54,;-2,.77,;-.67,1.54,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,;3.33,5.39,;4.67,6.16,;2,6.16,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:6.10,8.9,3.3,2.1,(-2,2.69,;-3.33,1.93,;-3.33,.38,;-2,-.38,;-.67,.39,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)O |r,wU:6.10,8.9,3.3,2.1,(-2,3.57,;-3.33,2.8,;-3.33,1.26,;-2,.49,;-.67,1.26,;-2,-1.05,;-3.33,-1.82,;-4.67,-1.05,;-4.67,.49,;-6,1.26,;-3.33,-3.36,;-4.67,-4.13,;-4.67,-5.67,;-3.33,-6.44,;-2,-5.67,;-2,-4.13,;-.67,-3.36,;.67,-4.13,;.67,-5.67,;2,-3.36,;3.33,-4.13,;4.67,-3.36,;4.67,-1.82,;6,-1.05,;3.33,-1.05,;2,-1.82,;3.33,.49,;2,1.26,;.67,.49,;2,2.8,;3.33,3.57,;4.67,2.8,;4.67,1.26,;6,.49,;3.33,5.11,;1.79,5.11,;2.56,6.44,;4.67,5.88,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:6.10,8.9,3.3,2.1,(-2,3.49,;-3.33,2.72,;-3.33,1.18,;-2,.41,;-.67,1.18,;-2,-1.13,;-3.33,-1.9,;-4.67,-1.13,;-4.67,.41,;-6,1.18,;-3.33,-3.44,;-4.67,-4.21,;-4.67,-5.75,;-3.33,-6.52,;-2,-5.75,;-2,-4.21,;-.67,-3.44,;.67,-4.21,;.67,-5.75,;2,-3.44,;3.33,-4.21,;4.67,-3.44,;4.67,-1.9,;6,-1.13,;3.33,-1.13,;2,-1.9,;3.33,.41,;2,1.18,;.67,.41,;2,2.72,;3.33,3.49,;4.67,2.72,;4.67,1.18,;6,.41,;3.33,5.03,;4.67,5.8,;2.94,6.52,;1.45,6.12,;1.85,4.63,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1CCOCC1 |r,wU:6.10,8.9,3.3,2.1,(-2,2.69,;-3.33,1.93,;-3.33,.38,;-2,-.38,;-.67,.39,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OC)[C@H](N)C1 |r,wU:28.30,35.38,30.33,32.35,(6,7.31,;4.67,6.54,;4.67,5,;3.33,4.23,;3.33,2.69,;2,1.93,;2,.38,;.67,-.38,;3.33,-.38,;4.67,.38,;6,-.38,;4.67,1.93,;3.33,-1.93,;2,-2.69,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;.67,-5,;.67,-6.54,;-.67,-4.23,;-2,-5,;-2,-6.54,;-3.33,-7.31,;-4.67,-6.54,;-4.67,-5,;-3.33,-4.23,;-3.33,-2.69,;-2,-1.92,;-2,-.38,;-.67,.39,;-3.33,.38,;-3.33,1.93,;-2,2.69,;-4.67,-.38,;-6,.39,;-4.67,-1.92,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC(C)C)cc1F |r,wU:6.10,8.9,3.3,2.1,(-2,3.08,;-3.33,2.31,;-3.33,.77,;-2,,;-.67,.77,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;.67,-6.16,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;3.33,4.62,;4.67,5.39,;4.67,6.93,;6,4.62,;4.67,2.31,;4.67,.77,;6,,)|
CO[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:6.10,8.9,3.3,2.1,(-2,4.23,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
CO[C@@H]1[C@H](C)C[C@@H](C[C@@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wD:6.10,8.9,3.3,2.1,(-2,4.23,;-3.33,3.47,;-3.33,1.93,;-2,1.16,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccnc(n1)-c1c(F)cccc1F |r|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1N1C[C@H](C)[C@H](NC(=O)OC)[C@H](N)C1 |r,wU:39.42,31.34,33.36,(6.67,8.08,;6.67,6.54,;5.33,5.78,;5.33,4.23,;4,3.47,;4,1.93,;2.67,1.15,;2.67,-.38,;1.33,-1.15,;4,-1.15,;5.33,-.38,;6.67,-1.15,;5.33,1.15,;4,-2.69,;2.67,-3.47,;2.67,-5,;4,-5.77,;5.33,-5,;5.33,-3.47,;6.67,-2.69,;1.33,-5.78,;1.33,-7.31,;,-5,;-1.33,-5.78,;-1.33,-7.31,;-2.67,-8.08,;-4,-7.31,;-4,-5.78,;-2.67,-5,;-2.67,-3.47,;-1.33,-2.69,;-1.33,-1.15,;,-.38,;-2.67,-.38,;-2.67,1.15,;-4,1.93,;-4,3.47,;-5.33,1.15,;-6.67,1.93,;-4,-1.15,;-5.33,-.38,;-4,-2.69,)|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](NC(=O)OC)[C@H](N)C1 |r,wU:29.31,39.42,31.34,33.36,(6.67,8.08,;6.67,6.54,;5.33,5.78,;5.33,4.23,;4,3.47,;4,1.93,;2.67,1.15,;2.67,-.38,;1.33,-1.15,;4,-1.15,;5.33,-.38,;6.67,-1.15,;5.33,1.15,;4,-2.69,;2.67,-3.47,;2.67,-5,;4,-5.77,;5.33,-5,;5.33,-3.47,;6.67,-2.69,;1.33,-5.78,;1.33,-7.31,;,-5,;-1.33,-5.78,;-1.33,-7.31,;-2.67,-8.08,;-4,-7.31,;-4,-5.78,;-2.67,-5,;-2.67,-3.47,;-1.33,-2.69,;-1.33,-1.15,;,-.38,;-2.67,-.38,;-2.67,1.15,;-4,1.93,;-4,3.47,;-5.33,1.15,;-6.67,1.93,;-4,-1.15,;-5.33,-.38,;-4,-2.69,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:3.12,5.5,1.0,7.8,(-1.33,.39,;-2.67,-.38,;-2.67,-1.92,;-4,-2.7,;-5.33,-1.92,;-5.33,-.38,;-6.67,.39,;-4,.38,;-4,1.92,;-5.33,2.69,;-2.67,2.7,;-2.67,1.15,;-4,-4.24,;-5.33,-5.01,;-5.33,-6.55,;-4,-7.32,;-2.67,-6.55,;-2.67,-5.01,;-1.33,-4.24,;,-5.01,;,-6.55,;1.33,-4.24,;2.67,-5,;4,-4.24,;4,-2.7,;5.33,-1.92,;2.67,-1.93,;1.33,-2.7,;2.67,-.39,;1.33,.38,;,-.39,;1.33,1.92,;2.67,2.69,;2.67,4.23,;4,5,;5.33,4.23,;6.67,5,;6.67,6.54,;5.33,7.32,;4,6.54,;4,1.92,;4,.38,;5.33,-.39,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:3.12,5.5,1.0,7.8,(-.67,.84,;-2,.07,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,.84,;-3.33,2.38,;-4.67,3.15,;-2,3.15,;-2,1.61,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.67,3.92,;4.42,5.77,;3.33,6.86,;2.25,5.77,)|
CC(C)NC(=O)c1ccc(F)c(c1)-c1ccc(N)c(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)S(C)(=O)=O |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:3.12,5.5,1.0,7.8,(-.67,.39,;-2,-.38,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,.38,;-3.33,1.93,;-2,2.7,;-4.67,2.69,;-3.33,3.47,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
CC(C)NC(=O)c1ccc(F)c(c1)-c1ccc(N)c(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCC#N)[C@H](N)C1 |r|
COc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)S(C)(=O)=O |r,wU:26.28,31.34,28.31,30.37,(4.67,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,3.08,;-4.87,3.08,;-3.33,4.62,;-1.79,3.08,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1Oc1ccccn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.16,5.5,1.0,7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-2,3.85,;-.67,3.08,;.67,3.85,;.67,5.39,;-.67,6.16,;-2,5.39,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)S(C)(=O)=O |r,wU:28.30,33.36,30.33,32.39,(-1.22,6.16,;.12,5.39,;1.45,6.16,;2.78,5.39,;2.78,3.85,;1.45,3.08,;1.45,1.54,;.12,.77,;2.78,.77,;4.12,1.54,;5.45,.77,;4.12,3.08,;2.78,-.77,;1.45,-1.54,;1.45,-3.08,;2.78,-3.85,;4.12,-3.08,;4.12,-1.54,;5.45,-.77,;.12,-3.85,;.12,-5.39,;-1.22,-3.08,;-2.55,-3.85,;-2.55,-5.39,;-3.88,-6.16,;-5.22,-5.39,;-5.22,-3.85,;-3.88,-3.08,;-3.88,-1.54,;-2.55,-.77,;-2.55,.77,;-1.22,1.54,;-3.88,1.54,;-5.22,.77,;-6.55,1.54,;-5.22,-.77,;-3.88,3.08,;-5.22,3.85,;-3.88,4.62,;-2.55,3.85,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:6.10,8.9,3.3,wD:2.1,(-2,2.69,;-3.33,1.93,;-3.33,.38,;-2,-.38,;-.67,.39,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:3.15,5.5,1.0,7.8,(.1,.39,;-1.23,-.38,;-1.23,-1.92,;-2.56,-2.69,;-3.9,-1.92,;-3.9,-.38,;-5.23,.39,;-2.56,.38,;-2.56,1.93,;-3.9,2.69,;-3.9,4.23,;-5.23,5,;-5.23,6.54,;-6.77,5,;-6,3.67,;-2.56,-4.23,;-3.9,-5,;-3.9,-6.54,;-2.56,-7.31,;-1.23,-6.54,;-1.23,-5,;.1,-4.23,;1.44,-5,;1.44,-6.54,;2.77,-4.23,;4.1,-5,;5.44,-4.23,;5.44,-2.69,;6.77,-1.92,;4.1,-1.93,;2.77,-2.69,;4.1,-.38,;2.77,.38,;1.44,-.38,;2.77,1.93,;4.1,2.69,;5.44,1.93,;5.44,.38,;6.77,-.38,;4.1,4.23,;5.44,3.47,;5.44,5,;5.44,6.54,;4.1,7.31,;2.77,6.54,;2.77,5,)|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)S(C)(=O)=O |r,wU:29.31,34.37,31.34,33.40,(7.34,5.39,;6,6.16,;4.67,5.39,;3.33,6.16,;2,5.39,;2,3.85,;.67,3.08,;.67,1.54,;-.67,.77,;2,.77,;3.33,1.54,;4.67,.77,;3.33,3.08,;2,-.77,;.67,-1.54,;.67,-3.08,;2,-3.85,;3.33,-3.08,;3.33,-1.54,;4.67,-.77,;-.67,-3.85,;-.67,-5.39,;-2,-3.08,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-6,-5.39,;-6,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-3.33,-.77,;-3.33,.77,;-2,1.54,;-4.67,1.54,;-6,.77,;-7.34,1.54,;-6,-.77,;-4.67,3.08,;-3.33,3.85,;-6,3.85,;-5.44,4.41,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:3.12,5.5,1.0,7.8,(-.67,.39,;-2,-.38,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,.38,;-3.33,1.93,;-2,2.69,;-4.67,2.7,;-4.1,3.26,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1S(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:3.12,5.5,1.0,7.8,(-.67,1.93,;-2,1.16,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.16,;-6,1.93,;-3.33,1.93,;-3.33,3.47,;-2,4.23,;-4.67,4.24,;-4.1,4.8,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;3.33,-3.46,;4.67,-2.69,;4.67,-1.15,;6,-.38,;3.33,-.38,;2,-1.15,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;3.33,5.78,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1Oc1ccccn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.16,5.5,1.0,7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-2,3.85,;-.67,3.08,;.67,3.85,;.67,5.39,;-.67,6.16,;-2,5.39,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H](OC)[C@H](N)C1 |r,wU:29.31,36.39,31.34,wD:33.36,(7.34,5.39,;6,6.16,;4.67,5.39,;3.33,6.16,;2,5.39,;2,3.85,;.67,3.08,;.67,1.54,;-.67,.77,;2,.77,;3.33,1.54,;4.67,.77,;3.33,3.08,;2,-.77,;.67,-1.54,;.67,-3.08,;2,-3.85,;3.33,-3.08,;3.33,-1.54,;4.67,-.77,;-.67,-3.85,;-.67,-5.39,;-2,-3.08,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-6,-5.39,;-6,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-3.33,-.77,;-3.33,.77,;-2,1.54,;-4.67,1.54,;-4.67,3.08,;-3.33,3.85,;-6,.77,;-7.34,1.54,;-6,-.77,)|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCS(C)(=O)=O)[C@H](N)C1 |r,wU:28.30,40.43,30.33,32.35,(,5.39,;1.33,4.62,;2.67,5.39,;4,4.62,;4,3.08,;2.67,2.31,;2.67,.77,;1.33,,;4,,;5.33,.77,;6.67,,;5.33,2.31,;4,-1.54,;2.67,-2.31,;2.67,-3.85,;4,-4.62,;5.33,-3.85,;5.33,-2.31,;6.67,-1.54,;1.33,-4.62,;1.33,-6.16,;,-3.85,;-1.33,-4.62,;-1.33,-6.16,;-2.67,-6.93,;-4,-6.16,;-4,-4.62,;-2.67,-3.85,;-2.67,-2.31,;-1.33,-1.54,;-1.33,,;,.77,;-2.67,.77,;-2.67,2.31,;-4,3.08,;-4,4.62,;-5.33,5.39,;-6.67,4.62,;-5.33,6.93,;-4,6.16,;-4,,;-5.33,.77,;-4,-1.54,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(ccc1N)-c1cc(ccc1F)C(=O)NC(C)C |r|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:6.10,8.9,3.3,wD:2.1,(-2,2.7,;-3.33,1.93,;-3.33,.38,;-2,-.38,;-.67,.39,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
CC(C)NC(=O)c1ccc(F)c(c1)-c1ccc(N)c(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCS(C)(=O)=O)[C@H](N)C1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:3.15,1.0,5.5,7.8,(,.39,;-1.33,-.38,;-1.33,-1.92,;-2.67,-2.69,;-4,-1.92,;-4,-.38,;-5.33,.39,;-2.67,.38,;-2.67,1.93,;-4,2.69,;-4,4.23,;-5.33,5,;-6.67,4.23,;-6.1,6.34,;-4.56,6.34,;-2.67,-4.23,;-4,-5,;-4,-6.54,;-2.67,-7.31,;-1.33,-6.54,;-1.33,-5,;,-4.23,;1.33,-5,;1.33,-6.54,;2.67,-4.23,;4,-5,;5.33,-4.23,;5.33,-2.69,;6.67,-1.93,;4,-1.93,;2.67,-2.69,;4,-.38,;2.67,.39,;1.33,-.38,;2.67,1.93,;4,2.69,;5.33,1.93,;5.33,.39,;6.67,-.38,;4,4.23,;5.33,3.47,;5.33,5,;5.33,6.54,;4,7.31,;2.67,6.54,;2.67,5,)|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCS(C)(=O)=O)[C@H](N)C1 |r,wU:29.31,31.34,41.44,33.36,(8,4.62,;6.67,5.39,;5.33,4.62,;4,5.39,;2.67,4.62,;2.67,3.08,;1.33,2.31,;1.33,.77,;;2.67,,;4,.77,;5.33,,;4,2.31,;2.67,-1.54,;1.33,-2.31,;1.33,-3.85,;2.67,-4.62,;4,-3.85,;4,-2.31,;5.33,-1.54,;,-4.62,;,-6.16,;-1.33,-3.85,;-2.67,-4.62,;-2.67,-6.16,;-4,-6.93,;-5.33,-6.16,;-5.33,-4.62,;-4,-3.85,;-4,-2.31,;-2.67,-1.54,;-2.67,,;-1.33,.77,;-4,.77,;-4,2.31,;-5.33,3.08,;-5.33,4.62,;-6.67,5.39,;-6.67,6.93,;-7.44,4.06,;-8,6.16,;-5.33,,;-6.67,.77,;-5.33,-1.54,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1C1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:31.34,34.37,33.40,(7.34,5.39,;6,6.16,;4.67,5.39,;3.33,6.16,;2,5.39,;2,3.85,;.67,3.08,;.67,1.54,;-.67,.77,;2,.77,;3.33,1.54,;4.67,.77,;3.33,3.08,;2,-.77,;.67,-1.54,;.67,-3.08,;2,-3.85,;3.33,-3.08,;3.33,-1.54,;4.67,-.77,;-.67,-3.85,;-.67,-5.39,;-2,-3.08,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-6,-5.39,;-6,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-3.33,-.77,;-3.33,.77,;-2,1.54,;-4.67,1.54,;-6,.77,;-7.34,1.54,;-6,-.77,;-4.67,3.08,;-5.91,3.99,;-5.44,5.45,;-3.9,5.45,;-3.42,3.99,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H](OC)[C@H](N)C1 |r,wU:28.30,30.33,35.38,wD:32.35,(-.67,6.16,;.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-3.33,3.08,;-2,3.85,;-4.67,.77,;-6,1.54,;-4.67,-.77,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:6.10,3.3,8.9,wD:2.1,(-5.33,2.69,;-4,1.93,;-4,.38,;-2.67,-.38,;-1.33,.38,;-2.67,-1.93,;-4,-2.69,;-5.33,-1.93,;-5.33,-.38,;-6.67,.38,;-4,-4.23,;-5.33,-5,;-5.33,-6.54,;-4,-7.31,;-2.67,-6.54,;-2.67,-5,;-1.33,-4.23,;,-5,;,-6.54,;1.33,-4.23,;2.67,-5,;4,-4.23,;4,-2.69,;5.33,-1.92,;2.67,-1.93,;1.33,-2.69,;2.67,-.38,;1.33,.38,;,-.38,;1.33,1.93,;2.67,2.69,;2.67,4.23,;4,5,;5.33,4.24,;6.67,5,;6.67,6.54,;5.33,7.31,;4,6.54,;4,1.93,;4,.38,;5.33,-.38,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:6.10,3.3,8.9,wD:2.1,(-4.67,3.15,;-3.33,2.38,;-3.33,.84,;-2,.07,;-.67,.84,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.67,3.92,;4.42,5.78,;3.33,6.86,;2.25,5.78,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:3.15,1.0,5.5,wD:7.8,(-.2,.84,;-1.53,.07,;-1.53,-1.47,;-2.87,-2.24,;-4.2,-1.47,;-4.2,.07,;-5.53,.84,;-2.87,.84,;-2.87,2.38,;-4.2,3.15,;-3.8,4.63,;-5.14,5.4,;-6.47,4.63,;-5.91,6.74,;-4.37,6.74,;-2.87,-3.78,;-4.2,-4.55,;-4.2,-6.09,;-2.87,-6.86,;-1.53,-6.09,;-1.53,-4.55,;-.2,-3.78,;1.13,-4.55,;1.13,-6.09,;2.47,-3.78,;3.8,-4.55,;5.14,-3.78,;5.14,-2.24,;6.47,-1.47,;3.8,-1.47,;2.47,-2.24,;3.8,.07,;2.47,.84,;1.13,.07,;2.47,2.38,;3.8,3.15,;5.14,2.38,;5.14,.84,;6.47,.07,;3.8,4.69,;5.14,3.92,;4.89,5.78,;3.8,6.86,;2.71,5.78,)|
C[C@H]1C[C@H](C[C@@H](N)[C@@H]1OCCS(C)(=O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:3.15,1.0,5.5,wD:7.8,(-.87,.38,;-2.2,-.38,;-2.2,-1.93,;-3.53,-2.69,;-4.87,-1.93,;-4.87,-.38,;-6.2,.38,;-3.53,.38,;-3.53,1.93,;-4.87,2.69,;-4.47,4.18,;-5.8,4.95,;-7.14,4.18,;-6.57,6.29,;-5.03,6.29,;-3.53,-4.23,;-4.87,-5,;-4.87,-6.54,;-3.53,-7.31,;-2.2,-6.54,;-2.2,-5,;-.87,-4.23,;.47,-5,;.47,-6.54,;1.8,-4.23,;3.13,-5,;4.47,-4.23,;4.47,-2.69,;5.8,-1.92,;3.13,-1.93,;1.8,-2.69,;3.13,-.38,;1.8,.38,;.47,-.38,;1.8,1.93,;3.13,2.69,;3.13,4.23,;4.47,5,;5.8,4.24,;7.14,5,;7.14,6.54,;5.8,7.31,;4.47,6.54,;4.47,1.93,;4.47,.38,;5.8,-.38,)|
CC(C)Oc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCS(C)(=O)=O)[C@H](N)C1 |r,wU:28.30,30.33,40.43,32.35,(6,6.93,;6,5.39,;7.34,4.62,;4.67,4.62,;4.67,3.08,;3.33,2.31,;3.33,.77,;2,,;4.67,,;6,.77,;7.34,,;6,2.31,;4.67,-1.54,;3.33,-2.31,;3.33,-3.85,;4.67,-4.62,;6,-3.85,;6,-2.31,;7.34,-1.54,;2,-4.62,;2,-6.16,;.67,-3.85,;-.67,-4.62,;-.67,-6.16,;-2,-6.93,;-3.33,-6.16,;-3.33,-4.62,;-2,-3.85,;-2,-2.31,;-.67,-1.54,;-.67,,;.67,.77,;-2,.77,;-2,2.31,;-3.33,3.08,;-4.67,2.31,;-6,3.08,;-6.77,1.75,;-7.34,3.85,;-5.23,4.41,;-3.33,,;-4.67,.77,;-3.33,-1.54,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC(C)C)cc1F |r,wU:6.10,3.3,8.9,wD:2.1,(-2,3.08,;-3.33,2.31,;-3.33,.77,;-2,,;-.67,.77,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;.67,-6.16,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;3.33,4.62,;4.67,5.39,;4.67,6.93,;6,4.62,;4.67,2.31,;4.67,.77,;6,,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC)cc1F |r,wU:6.10,3.3,8.9,wD:2.1,(-4.67,3.85,;-3.33,3.08,;-3.33,1.54,;-2,.77,;-.67,1.54,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;4.67,3.08,;4.67,1.54,;6,.77,)|
COc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCS(C)(=O)=O)[C@H](N)C1 |r,wU:26.28,28.31,38.41,30.33,(5.33,5.49,;4,4.72,;4,3.18,;2.67,2.41,;2.67,.87,;1.33,.1,;4,.1,;5.33,.87,;6.67,.1,;5.33,2.41,;4,-1.44,;2.67,-2.21,;2.67,-3.75,;4,-4.52,;5.33,-3.75,;5.33,-2.21,;6.67,-1.44,;1.33,-4.52,;1.33,-6.06,;,-3.75,;-1.33,-4.52,;-1.33,-6.06,;-2.67,-6.83,;-4,-6.06,;-4,-4.52,;-2.67,-3.75,;-2.67,-2.21,;-1.33,-1.44,;-1.33,.1,;,.87,;-2.67,.87,;-2.67,2.41,;-4,3.18,;-4,4.72,;-5.33,5.49,;-6.1,4.16,;-6.67,6.26,;-4.56,6.83,;-4,.1,;-5.33,.87,;-4,-1.44,)|
CO[C@@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:6.10,3.3,8.9,wD:2.1,(-4.67,5,;-3.33,4.23,;-3.33,2.69,;-2,1.93,;-.67,2.69,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;.67,-4.23,;2,-1.93,;2,-.38,;3.33,.38,;4.67,-.38,;6,.39,;4.67,-1.93,;3.33,-2.69,;3.33,-4.23,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
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CC(C)Oc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:30.33,33.36,32.39,(4.02,7.06,;4.42,5.58,;5.91,5.18,;3.33,4.49,;3.33,2.95,;2,2.18,;2,.64,;.67,-.13,;3.33,-.13,;4.67,.64,;6,-.13,;4.67,2.18,;3.33,-1.67,;2,-2.44,;2,-3.98,;3.33,-4.75,;4.67,-3.98,;4.67,-2.44,;6,-1.67,;.67,-4.75,;.67,-6.29,;-.67,-3.98,;-2,-4.75,;-2,-6.29,;-3.33,-7.06,;-4.67,-6.29,;-4.67,-4.75,;-3.33,-3.98,;-3.33,-2.44,;-2,-1.67,;-2,-.13,;-.67,.64,;-3.33,.64,;-4.67,-.13,;-6,.64,;-4.67,-1.67,;-3.33,2.18,;-4.58,3.08,;-4.1,4.55,;-2.56,4.55,;-2.09,3.08,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC(C)C)cc1F |r,wU:6.6,11.12,5.4,(.67,3.08,;-.67,2.31,;-2,3.08,;-2,4.62,;-3.33,2.31,;-3.33,.77,;-2,,;-.67,.77,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;.67,-6.16,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;3.33,4.62,;4.67,5.39,;4.67,6.93,;6,4.62,;4.67,2.31,;4.67,.77,;6,,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC(C)C)cc1F |r,wU:9.13,6.6,11.12,5.4,(.67,3.08,;-.67,2.31,;-2,3.08,;-2,4.62,;-3.33,2.31,;-3.33,.77,;-2,,;-.67,.77,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;.67,-6.16,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;3.33,4.62,;4.67,5.39,;4.67,6.93,;6,4.62,;4.67,2.31,;4.67,.77,;6,,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1n1ccccc1=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.16,1.0,5.5,7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-4.67,3.85,;-4.67,5.39,;-3.33,6.16,;-2,5.39,;-2,3.85,;-.67,3.08,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:1.0,5.5,7.8,(-.67,.38,;-2,-.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,.38,;-3.33,1.93,;-4.58,2.83,;-4.1,4.29,;-2.56,4.29,;-2.09,2.83,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccccc1=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.16,1.0,5.5,7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-4.67,3.85,;-4.67,5.39,;-3.33,6.16,;-2,5.39,;-2,3.85,;-.67,3.08,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:3.13,1.0,5.5,7.8,(,.38,;-1.33,-.38,;-1.33,-1.93,;-2.67,-2.69,;-4,-1.93,;-4,-.38,;-5.33,.38,;-2.67,.38,;-2.67,1.93,;-4,2.69,;-4,4.23,;-5.33,5,;-6.67,5.78,;-2.67,-4.23,;-4,-5,;-4,-6.54,;-2.67,-7.31,;-1.33,-6.54,;-1.33,-5,;,-4.23,;1.33,-5,;1.33,-6.54,;2.67,-4.23,;4,-5,;5.33,-4.23,;5.33,-2.69,;6.67,-1.92,;4,-1.93,;2.67,-2.69,;4,-.38,;2.67,.38,;1.33,-.38,;2.67,1.93,;4,2.69,;5.33,1.93,;5.33,.38,;6.67,-.38,;4,4.23,;5.33,3.47,;5.33,5,;5.33,6.54,;4,7.31,;2.67,6.54,;2.67,5,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:28.30,30.33,33.36,32.39,(-.67,6.16,;.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,3.08,;-4.58,3.99,;-4.1,5.45,;-2.56,5.45,;-2.09,3.99,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:30.33,33.36,32.39,(-.67,6.16,;.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,3.08,;-4.58,3.99,;-4.1,5.45,;-2.56,5.45,;-2.09,3.99,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:6.6,11.12,5.4,(-6.5,4.16,;-5.41,3.07,;-3.92,3.47,;-3.53,4.95,;-2.84,2.38,;-2.84,.84,;-1.5,.07,;-.17,.84,;-1.5,-1.47,;-2.84,-2.24,;-4.17,-1.47,;-4.17,.07,;-5.5,.84,;-2.84,-3.78,;-4.17,-4.55,;-4.17,-6.09,;-2.84,-6.86,;-1.5,-6.09,;-1.5,-4.55,;-.17,-3.78,;1.17,-4.55,;1.17,-6.09,;2.5,-3.78,;3.83,-4.55,;5.17,-3.78,;5.17,-2.24,;6.5,-1.47,;3.83,-1.47,;2.5,-2.24,;3.83,.07,;2.5,.84,;1.17,.07,;2.5,2.38,;3.83,3.15,;5.17,2.38,;5.17,.84,;6.5,.07,;3.83,4.69,;5.17,3.92,;4.92,5.78,;3.83,6.86,;2.74,5.78,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:6.6,11.12,5.4,(-7.17,3.7,;-6.08,2.62,;-4.59,3.01,;-4.19,4.5,;-3.5,1.93,;-3.5,.38,;-2.17,-.38,;-.83,.38,;-2.17,-1.93,;-3.5,-2.69,;-4.84,-1.93,;-4.84,-.38,;-6.17,.38,;-3.5,-4.23,;-4.84,-5,;-4.84,-6.54,;-3.5,-7.31,;-2.17,-6.54,;-2.17,-5,;-.83,-4.23,;.5,-5,;.5,-6.54,;1.83,-4.23,;3.17,-5,;4.5,-4.23,;4.5,-2.69,;5.83,-1.92,;3.17,-1.93,;1.83,-2.69,;3.17,-.38,;1.83,.38,;.5,-.38,;1.83,1.93,;3.17,2.69,;3.17,4.23,;4.5,5,;5.83,4.24,;7.17,5,;7.17,6.54,;5.83,7.31,;4.5,6.54,;4.5,1.93,;4.5,.38,;5.83,-.38,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:1.0,5.5,7.8,(-.67,.38,;-2,-.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,.38,;-3.33,1.93,;-4.58,2.83,;-4.1,4.29,;-2.56,4.29,;-2.09,2.83,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5.01,;4.67,6.55,;3.33,7.31,;2,6.55,;2,5.01,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;3.33,5.75,;4.67,3.44,;4.67,1.9,;6,1.13,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1COC1 |r,wU:6.6,11.12,5.4,(.67,3.15,;-.67,2.38,;-2,3.15,;-2,4.69,;-3.33,2.38,;-3.33,.84,;-2,.07,;-.67,.84,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.42,5.78,;3.33,6.86,;2.25,5.78,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1COC1 |r,wU:3.13,1.0,5.5,7.8,(-.67,.84,;-2,.07,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,.84,;-3.33,2.38,;-2.25,3.47,;-.76,3.07,;.33,4.16,;1.42,5.24,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.42,5.78,;3.33,6.86,;2.25,5.78,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1COC1 |r,wU:1.0,5.5,7.8,(-.67,.84,;-2,.07,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,.84,;-3.33,2.38,;-4.58,3.28,;-4.1,4.75,;-2.56,4.75,;-2.09,3.28,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.42,5.78,;3.33,6.86,;2.25,5.78,)|
COc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](OCCC#N)[C@H](N)C1 |r,wU:26.28,28.31,36.39,30.33,(4.67,5.78,;3.33,5,;3.33,3.47,;2,2.69,;2,1.15,;.67,.38,;3.33,.38,;4.67,1.15,;6,.38,;4.67,2.69,;3.33,-1.15,;2,-1.93,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;.67,-4.23,;.67,-5.78,;-.67,-3.47,;-2,-4.23,;-2,-5.78,;-3.33,-6.54,;-4.67,-5.78,;-4.67,-4.23,;-3.33,-3.47,;-3.33,-1.93,;-2,-1.15,;-2,.38,;-.67,1.15,;-3.33,1.15,;-3.33,2.69,;-2,3.47,;-2,5,;-.67,5.78,;.67,6.54,;-4.67,.38,;-6,1.15,;-4.67,-1.15,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,7.8,(-.67,1.15,;-2,.38,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-6,1.15,;-3.33,1.15,;-3.33,2.69,;-2,3.47,;-2,5,;-.67,5.78,;.67,6.54,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;.67,-5.78,;2,-3.47,;2,-1.93,;3.33,-1.15,;4.67,-1.93,;6,-1.15,;4.67,-3.47,;3.33,-4.23,;3.33,-5.77,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;4.67,2.69,;4.67,1.15,;6,.38,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:9.13,6.6,11.12,5.4,(-6.5,4.16,;-5.41,3.07,;-3.92,3.47,;-3.53,4.95,;-2.84,2.38,;-2.84,.84,;-1.5,.07,;-.17,.84,;-1.5,-1.47,;-2.84,-2.24,;-4.17,-1.47,;-4.17,.07,;-5.5,.84,;-2.84,-3.78,;-4.17,-4.55,;-4.17,-6.09,;-2.84,-6.86,;-1.5,-6.09,;-1.5,-4.55,;-.17,-3.78,;1.17,-4.55,;1.17,-6.09,;2.5,-3.78,;3.83,-4.55,;5.17,-3.78,;5.17,-2.24,;6.5,-1.47,;3.83,-1.47,;2.5,-2.24,;3.83,.07,;2.5,.84,;1.17,.07,;2.5,2.38,;3.83,3.15,;5.17,2.38,;5.17,.84,;6.5,.07,;3.83,4.69,;5.17,3.92,;4.92,5.78,;3.83,6.86,;2.74,5.78,)|
COCCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:29.31,31.34,34.37,33.40,(7.34,5.39,;6,6.16,;4.67,5.39,;3.33,6.16,;2,5.39,;2,3.85,;.67,3.08,;.67,1.54,;-.67,.77,;2,.77,;3.33,1.54,;4.67,.77,;3.33,3.08,;2,-.77,;.67,-1.54,;.67,-3.08,;2,-3.85,;3.33,-3.08,;3.33,-1.54,;4.67,-.77,;-.67,-3.85,;-.67,-5.39,;-2,-3.08,;-3.33,-3.85,;-3.33,-5.39,;-4.67,-6.16,;-6,-5.39,;-6,-3.85,;-4.67,-3.08,;-4.67,-1.54,;-3.33,-.77,;-3.33,.77,;-2,1.54,;-4.67,1.54,;-6,.77,;-7.34,1.54,;-6,-.77,;-4.67,3.08,;-5.91,3.99,;-5.44,5.45,;-3.9,5.45,;-3.42,3.99,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:9.13,6.6,11.12,5.4,(-7.17,3.7,;-6.08,2.62,;-4.59,3.01,;-4.19,4.5,;-3.5,1.93,;-3.5,.38,;-2.17,-.38,;-.83,.38,;-2.17,-1.93,;-3.5,-2.69,;-4.84,-1.93,;-4.84,-.38,;-6.17,.38,;-3.5,-4.23,;-4.84,-5,;-4.84,-6.54,;-3.5,-7.31,;-2.17,-6.54,;-2.17,-5,;-.83,-4.23,;.5,-5,;.5,-6.54,;1.83,-4.23,;3.17,-5,;4.5,-4.23,;4.5,-2.69,;5.83,-1.92,;3.17,-1.93,;1.83,-2.69,;3.17,-.38,;1.83,.38,;.5,-.38,;1.83,1.93,;3.17,2.69,;3.17,4.23,;4.5,5,;5.83,4.24,;7.17,5,;7.17,6.54,;5.83,7.31,;4.5,6.54,;4.5,1.93,;4.5,.38,;5.83,-.38,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:3.14,1.0,5.5,7.8,(-1.33,.38,;-2.67,-.38,;-2.67,-1.93,;-4,-2.69,;-5.33,-1.93,;-5.33,-.38,;-6.67,.38,;-4,.38,;-4,1.93,;-5.25,2.83,;-4.77,4.29,;-3.23,4.29,;-2.76,2.83,;-4,-4.23,;-5.33,-5,;-5.33,-6.54,;-4,-7.31,;-2.67,-6.54,;-2.67,-5,;-1.33,-4.23,;,-5,;,-6.54,;1.33,-4.23,;2.67,-5,;4,-4.23,;4,-2.69,;5.33,-1.92,;2.67,-1.93,;1.33,-2.69,;2.67,-.38,;1.33,.38,;,-.38,;1.33,1.93,;2.67,2.69,;2.67,4.23,;4,5,;5.33,4.24,;6.67,5,;6.67,6.54,;5.33,7.31,;4,6.54,;4,1.93,;4,.38,;5.33,-.38,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:3.14,1.0,5.5,7.8,(-.67,.84,;-2,.07,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,.84,;-3.33,2.38,;-4.58,3.28,;-4.1,4.75,;-2.56,4.75,;-2.09,3.28,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.67,3.92,;4.42,5.78,;3.33,6.86,;2.25,5.78,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC)cc1F |r,wU:6.6,11.12,5.4,(.67,3.85,;-.67,3.08,;-2,3.85,;-2,5.39,;-3.33,3.08,;-3.33,1.54,;-2,.77,;-.67,1.54,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;4.67,3.08,;4.67,1.54,;6,.77,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:6.6,11.12,5.4,(.67,4.23,;-.67,3.47,;-2,4.23,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.15,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.15,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;2,-1.15,;3.33,-.38,;4.67,-1.15,;6,-.38,;4.67,-2.69,;3.33,-3.46,;3.33,-5,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.15,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:9.13,6.6,11.12,5.4,(.67,4.23,;-.67,3.47,;-2,4.23,;-2,5.78,;-3.33,3.47,;-3.33,1.93,;-2,1.15,;-.67,1.93,;-2,-.38,;-3.33,-1.15,;-4.67,-.38,;-4.67,1.15,;-6,1.93,;-3.33,-2.69,;-4.67,-3.47,;-4.67,-5,;-3.33,-5.78,;-2,-5,;-2,-3.47,;-.67,-2.69,;.67,-3.47,;.67,-5,;2,-2.69,;2,-1.15,;3.33,-.38,;4.67,-1.15,;6,-.38,;4.67,-2.69,;3.33,-3.46,;3.33,-5,;3.33,1.15,;2,1.93,;.67,1.15,;2,3.47,;3.33,4.23,;4.67,3.47,;4.67,1.93,;6,1.15,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.14,1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;2,-1.18,;3.33,-.41,;4.67,-1.18,;6,-.41,;4.67,-2.72,;3.33,-3.49,;3.33,-5.03,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:6.6,11.12,5.4,(-6.67,2.69,;-5.33,1.93,;-4,2.69,;-4,4.23,;-2.67,1.93,;-2.67,.38,;-1.33,-.38,;,.38,;-1.33,-1.93,;-2.67,-2.69,;-4,-1.93,;-4,-.38,;-5.33,.38,;-2.67,-4.23,;-4,-5,;-4,-6.54,;-2.67,-7.31,;-1.33,-6.54,;-1.33,-5,;,-4.23,;1.33,-5,;1.33,-6.54,;2.67,-4.23,;4,-5,;5.33,-4.23,;5.33,-2.69,;6.67,-1.92,;4,-1.93,;2.67,-2.69,;4,-.38,;2.67,.38,;1.33,-.38,;2.67,1.93,;4,2.69,;5.33,1.93,;5.33,.38,;6.67,-.38,;4,4.23,;5.33,3.47,;5.33,5,;5.33,6.54,;4,7.31,;2.67,6.54,;2.67,5,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:9.13,6.6,11.12,5.4,(-6.67,2.69,;-5.33,1.93,;-4,2.69,;-4,4.23,;-2.67,1.93,;-2.67,.38,;-1.33,-.38,;,.38,;-1.33,-1.93,;-2.67,-2.69,;-4,-1.93,;-4,-.38,;-5.33,.38,;-2.67,-4.23,;-4,-5,;-4,-6.54,;-2.67,-7.31,;-1.33,-6.54,;-1.33,-5,;,-4.23,;1.33,-5,;1.33,-6.54,;2.67,-4.23,;4,-5,;5.33,-4.23,;5.33,-2.69,;6.67,-1.92,;4,-1.93,;2.67,-2.69,;4,-.38,;2.67,.38,;1.33,-.38,;2.67,1.93,;4,2.69,;5.33,1.93,;5.33,.38,;6.67,-.38,;4,4.23,;5.33,3.47,;5.33,5,;5.33,6.54,;4,7.31,;2.67,6.54,;2.67,5,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:3.14,1.0,5.5,7.8,(-.67,.38,;-2,-.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,.38,;-3.33,1.93,;-4.58,2.83,;-4.1,4.29,;-2.56,4.29,;-2.09,2.83,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:9.13,6.6,11.12,5.4,(-6.67,4.23,;-5.33,3.47,;-4,4.23,;-4,5.78,;-2.67,3.47,;-2.67,1.93,;-1.33,1.15,;,1.93,;-1.33,-.38,;-2.67,-1.15,;-4,-.38,;-4,1.15,;-5.33,1.93,;-2.67,-2.69,;-4,-3.47,;-4,-5,;-2.67,-5.78,;-1.33,-5,;-1.33,-3.47,;,-2.69,;1.33,-3.47,;1.33,-5,;2.67,-2.69,;4,-3.46,;5.33,-2.69,;5.33,-1.15,;6.67,-.38,;4,-.38,;2.67,-1.15,;4,1.15,;2.67,1.93,;1.33,1.15,;2.67,3.47,;4,4.23,;4,5.78,;5.33,3.47,;5.33,1.93,;6.67,1.15,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(C)cc1F |r,wU:3.14,1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;3.33,-3.49,;4.67,-2.72,;4.67,-1.18,;6,-.41,;3.33,-.41,;2,-1.18,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;3.33,5.75,;4.67,3.44,;4.67,1.9,;6,1.13,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1COC1 |r,wU:9.13,6.6,11.12,5.4,(.67,3.15,;-.67,2.38,;-2,3.15,;-2,4.69,;-3.33,2.38,;-3.33,.84,;-2,.07,;-.67,.84,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-4.67,.07,;-6,.84,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;.67,-6.09,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.42,5.77,;3.33,6.86,;2.25,5.77,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:3.13,1.0,5.5,7.8,(-.67,.38,;-2,-.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,.38,;-3.33,1.93,;-4.67,2.69,;-4.67,4.23,;-6,5,;-7.34,5.78,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;3.33,4.23,;4.67,5,;6,4.23,;7.34,5,;7.34,6.54,;6,7.31,;4.67,6.54,;4.67,1.93,;4.67,.38,;6,-.38,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCCC#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:3.13,1.0,5.5,7.8,(,.84,;-1.33,.07,;-1.33,-1.47,;-2.67,-2.24,;-4,-1.47,;-4,.07,;-5.33,.84,;-2.67,.84,;-2.67,2.38,;-4,3.15,;-4,4.69,;-5.33,5.46,;-6.67,6.23,;-2.67,-3.78,;-4,-4.55,;-4,-6.09,;-2.67,-6.86,;-1.33,-6.09,;-1.33,-4.55,;,-3.78,;1.33,-4.55,;1.33,-6.09,;2.67,-3.78,;4,-4.55,;5.33,-3.78,;5.33,-2.24,;6.67,-1.47,;4,-1.47,;2.67,-2.24,;4,.07,;2.67,.84,;1.33,.07,;2.67,2.38,;4,3.15,;5.33,2.38,;5.33,.84,;6.67,.07,;4,4.69,;5.33,3.92,;5.09,5.77,;4,6.86,;2.91,5.77,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1cc(nn1)C#N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.16,1.0,5.5,7.8,(-.67,.56,;-2,-.21,;-2,-1.75,;-3.33,-2.52,;-4.67,-1.75,;-4.67,-.21,;-6,.56,;-3.33,.56,;-3.33,2.1,;-4.58,3.01,;-4.1,4.47,;-2.56,4.47,;-2.09,3.01,;-4.87,5.8,;-5.64,7.14,;-3.33,-4.06,;-4.67,-4.83,;-4.67,-6.37,;-3.33,-7.14,;-2,-6.37,;-2,-4.83,;-.67,-4.06,;.67,-4.83,;.67,-6.37,;2,-4.06,;3.33,-4.83,;4.67,-4.06,;4.67,-2.52,;6,-1.75,;3.33,-1.75,;2,-2.52,;3.33,-.21,;2,.56,;.67,-.21,;2,2.1,;3.33,2.87,;4.67,2.1,;4.67,.56,;6,-.21,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1cc(nn1)C1CC1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.18,1.0,5.5,7.8,(-.33,.61,;-1.66,-.16,;-1.66,-1.7,;-2.99,-2.47,;-4.33,-1.7,;-4.33,-.16,;-5.66,.61,;-2.99,.61,;-2.99,2.15,;-4.24,3.05,;-3.76,4.52,;-2.22,4.52,;-1.75,3.05,;-4.85,5.61,;-5.25,7.09,;-6.34,6,;-2.99,-4.01,;-4.33,-4.78,;-4.33,-6.32,;-2.99,-7.09,;-1.66,-6.32,;-1.66,-4.78,;-.33,-4.01,;1.01,-4.78,;1.01,-6.32,;2.34,-4.01,;3.67,-4.78,;5.01,-4.01,;5.01,-2.47,;6.34,-1.7,;3.67,-1.7,;2.34,-2.47,;3.67,-.16,;2.34,.61,;1.01,-.16,;2.34,2.15,;3.67,2.92,;5.01,2.15,;5.01,.61,;6.34,-.16,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1cc(nn1)C(C)=C)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.17,1.0,5.5,7.8,(-.56,.56,;-1.9,-.21,;-1.9,-1.75,;-3.23,-2.52,;-4.56,-1.75,;-4.56,-.21,;-5.9,.56,;-3.23,.56,;-3.23,2.1,;-4.48,3.01,;-4,4.47,;-2.46,4.47,;-1.99,3.01,;-4.77,5.8,;-4,7.14,;-6.1,5.03,;-3.23,-4.06,;-4.56,-4.83,;-4.56,-6.37,;-3.23,-7.14,;-1.9,-6.37,;-1.9,-4.83,;-.56,-4.06,;.77,-4.83,;.77,-6.37,;2.1,-4.06,;3.44,-4.83,;4.77,-4.06,;4.77,-2.52,;6.1,-1.75,;3.44,-1.75,;2.1,-2.52,;3.44,-.21,;2.1,.56,;.77,-.21,;2.1,2.1,;3.44,2.87,;4.77,2.1,;4.77,.56,;6.1,-.21,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1cc(nn1)C(C)(C)O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.18,1.0,5.5,7.8,(-.49,.56,;-1.82,-.21,;-1.82,-1.75,;-3.15,-2.52,;-4.49,-1.75,;-4.49,-.21,;-5.82,.56,;-3.15,.56,;-3.15,2.1,;-4.4,3.01,;-3.92,4.47,;-2.38,4.47,;-1.91,3.01,;-4.69,5.8,;-3.92,7.14,;-6.18,5.41,;-5.46,7.14,;-3.15,-4.06,;-4.49,-4.83,;-4.49,-6.37,;-3.15,-7.14,;-1.82,-6.37,;-1.82,-4.83,;-.49,-4.06,;.85,-4.83,;.85,-6.37,;2.18,-4.06,;3.51,-4.83,;4.85,-4.06,;4.85,-2.52,;6.18,-1.75,;3.51,-1.75,;2.18,-2.52,;3.51,-.21,;2.18,.56,;.85,-.21,;2.18,2.1,;3.51,2.87,;4.85,2.1,;4.85,.56,;6.18,-.21,)|
C[C@@H]1C[C@@H](C[C@H](N)[C@@H]1OCC(O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wD:3.13,1.0,5.5,7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-2,3.85,;-2,5.39,;-3.33,6.16,;-.67,6.16,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1OCC(O)=O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.13,1.0,5.5,7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-2,3.85,;-2,5.39,;-3.33,6.16,;-.67,6.16,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC)cc1F |r,wU:9.13,6.6,11.12,5.4,(.67,3.85,;-.67,3.08,;-2,3.85,;-2,5.39,;-3.33,3.08,;-3.33,1.54,;-2,.77,;-.67,1.54,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;.67,-5.39,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;4.67,3.08,;4.67,1.54,;6,.77,)|
COc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:26.28,28.31,31.34,30.37,(4.67,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,3.08,;-4.58,3.99,;-4.1,5.45,;-2.56,5.45,;-2.09,3.99,)|
COc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r,wU:28.31,31.34,30.37,(4.67,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;.67,-3.85,;.67,-5.39,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,3.08,;-4.58,3.99,;-4.1,5.45,;-2.56,5.45,;-2.09,3.99,)|
C[C@H]1CN(C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:1.0,5.5,7.8,(-.67,1.9,;-2,1.13,;-2,-.41,;-3.33,-1.18,;-4.67,-.41,;-4.67,1.13,;-6,1.9,;-3.33,1.9,;-3.33,3.44,;-4.58,4.34,;-4.1,5.8,;-2.56,5.8,;-2.09,4.34,;-3.33,-2.72,;-4.67,-3.49,;-4.67,-5.03,;-3.33,-5.8,;-2,-5.03,;-2,-3.49,;-.67,-2.72,;.67,-3.49,;.67,-5.03,;2,-2.72,;2,-1.18,;3.33,-.41,;4.67,-1.18,;6,-.41,;4.67,-2.72,;3.33,-3.49,;3.33,-5.03,;3.33,1.13,;2,1.9,;.67,1.13,;2,3.44,;3.33,4.21,;4.67,3.44,;4.67,1.9,;6,1.13,)|
C[C@H]1C[C@H](C[C@@H](N)[C@H]1n1ccnn1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:3.14,1.0,5.5,7.8,(-.67,.38,;-2,-.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,.38,;-3.33,1.93,;-4.58,2.83,;-4.1,4.29,;-2.56,4.29,;-2.09,2.83,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
CC(C)NC(=O)c1ccc(F)c(c1)-c1ccc(N)c(n1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r|
CC(C)NC(=O)c1ccc(F)c(c1)-c1ccc(N)c(n1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H]([C@H](N)C1)n1ccnn1 |r|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1nc(ccc1N)-c1cc(ccc1F)C(=O)NC(C)C |r|
COC(=O)N[C@H]1[C@@H](C)CN(C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:6.6,11.12,5.4,(.67,2.69,;-.67,1.93,;-2,2.69,;-2,4.23,;-3.33,1.93,;-3.33,.38,;-2,-.38,;-.67,.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1nc(ccc1N)-c1cc(ccc1F)C(=O)NC(C)C |r|
COC(=O)N[C@H]1[C@@H](C)C[C@H](C[C@H]1N)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:9.13,6.6,11.12,5.4,(.67,2.69,;-.67,1.93,;-2,2.69,;-2,4.23,;-3.33,1.93,;-3.33,.38,;-2,-.38,;-.67,.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;.67,-6.54,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,3.47,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)[C@H](NC(=O)OC)[C@H](N)C1 |r,wU:28.30,30.33,38.41,32.35,(,6.16,;1.33,5.39,;2.67,6.16,;4,5.39,;4,3.85,;2.67,3.08,;2.67,1.54,;1.33,.77,;4,.77,;5.33,1.54,;6.67,.77,;5.33,3.08,;4,-.77,;2.67,-1.54,;2.67,-3.08,;4,-3.85,;5.33,-3.08,;5.33,-1.54,;6.67,-.77,;1.33,-3.85,;1.33,-5.39,;,-3.08,;-1.33,-3.85,;-1.33,-5.39,;-2.67,-6.16,;-4,-5.39,;-4,-3.85,;-2.67,-3.08,;-2.67,-1.54,;-1.33,-.77,;-1.33,.77,;,1.54,;-2.67,1.54,;-2.67,3.08,;-4,3.85,;-4,5.39,;-5.33,3.08,;-6.67,3.85,;-4,.77,;-5.33,1.54,;-4,-.77,)|
CCOCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnccc1N1C[C@H](C)[C@H](NC(=O)OC)[C@H](N)C1 |r,wU:30.33,38.41,32.35,(,6.16,;1.33,5.39,;2.67,6.16,;4,5.39,;4,3.85,;2.67,3.08,;2.67,1.54,;1.33,.77,;4,.77,;5.33,1.54,;6.67,.77,;5.33,3.08,;4,-.77,;2.67,-1.54,;2.67,-3.08,;4,-3.85,;5.33,-3.08,;5.33,-1.54,;6.67,-.77,;1.33,-3.85,;1.33,-5.39,;,-3.08,;-1.33,-3.85,;-1.33,-5.39,;-2.67,-6.16,;-4,-5.39,;-4,-3.85,;-2.67,-3.08,;-2.67,-1.54,;-1.33,-.77,;-1.33,.77,;,1.54,;-2.67,1.54,;-2.67,3.08,;-4,3.85,;-4,5.39,;-5.33,3.08,;-6.67,3.85,;-4,.77,;-5.33,1.54,;-4,-.77,)|
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|
CN(C)C1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2ccc(F)c(F)c2)C2CCCCC2)CC1
CN(C)C1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2ccnc(F)c2)C2CCCCC2)CC1
CN(C)C1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C2CCCCC2)CC1 |r|
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cc(Cl)ccc2F)C2CCCCC2)CC1 |r|
NCCC1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cccc(OC(F)(F)F)c1
NCCC1CNC(=O)c2cc(c(-c3ccsc3)n12)-c1cccc(OC(F)(F)F)c1
NCCC1CNC(=O)c2cc(c(-c3ccsc3)n12)-c1cc(Cl)ccc1F
NCCC1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cc(Cl)ccc1F
CN1CCN(Cc2ccc(cc2)-c2c(cc3C(=O)NCC(CCOC(=O)C(F)(F)F)n23)-c2cccc(OC(F)(F)F)c2)CC1
CN(C)Cc1ccc(cc1)-c1c(cc2C(=O)NCC(CCOC(=O)C(F)(F)F)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccsc3)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cccc(OC(F)(F)F)c1
Cc1cccc(c1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
NCCC1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cccc(Cl)c1
Cc1cccc(c1)-c1c(cc2C(=O)NCC(CCN)n12)-c1cccc(OC(F)(F)F)c1
NCCC1CNC(=O)c2cc(c(-c3cccc(N)c3)n12)-c1cccc(OC(F)(F)F)c1
Cc1cccc(c1)-c1c(cc2C(=O)NCC(CCN)n12)-c1cc(Cl)ccc1F
NCCC1CNC(=O)c2cc(c(-c3ccc(CO)cc3)n12)-c1cccc(OC(F)(F)F)c1
NCCC1CNC(=O)c2cc(c(-c3ccc(CO)cc3)n12)-c1cccc(c1)C(F)(F)F
NCCC1CNC(=O)c2cc(c(-c3ccsc3)n12)-c1cccc(c1)C(F)(F)F
NCCC1CNC(=O)c2cc(c(-c3ccc(CO)cc3)n12)-c1ccnc(Cl)c1
Cc1cccc(c1)-c1c(cc2C(=O)NCC(CCN)n12)-c1ccnc(Cl)c1
NCCC1CNC(=O)c2cc(c(-c3ccc(O)cc3)n12)-c1cccc(c1)C(F)(F)F
NC(=O)c1ccc(cc1)-c1c(cc2C(=O)NCC(CCO)n12)-c1cccc(OC(F)(F)F)c1
CN(C)C(=O)c1ccc(cc1)-c1c(cc2C(=O)NCC(CCO)n12)-c1cccc(OC(F)(F)F)c1
CN(C)CCNC(=O)c1ccc(cc1)-c1c(cc2C(=O)NCC(CCO)n12)-c1cccc(OC(F)(F)F)c1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1c(cc2C(=O)NCC(CCO)n12)-c1cccc(OC(F)(F)F)c1
CNC(=O)c1ccc(cc1)-c1c(cc2C(=O)NCC(CCO)n12)-c1cccc(OC(F)(F)F)c1
OCCC1CNC(=O)c2cc(c(-c3ccc(CO)cc3)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc(O)cc3)n12)-c1cccc(OC(F)(F)F)c1
CN(C)Cc1ccc(cc1)-c1c(cc2C(=O)NCC(CCCl)n12)-c1cccc(OC(F)(F)F)c1
CN1CCN(Cc2ccc(cc2)-c2c(cc3C(=O)NCC(CCCl)n23)-c2cccc(OC(F)(F)F)c2)CC1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc(F)cc3)n12)-c1cccc(OC(F)(F)F)c1
CC(=O)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
CS(=O)(=O)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc(C=O)cc3)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc(CN4CCOCC4)cc3)n12)-c1cccc(OC(F)(F)F)c1
CN1CCN(Cc2ccc(cc2)-c2c(cc3C(=O)NC[C@H](CCN)n23)-c2cccc(OC(F)(F)F)c2)CC1
CN(C)Cc1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
NCCC[C@H]1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cccc(OC(F)(F)F)c1
NCCC[C@H]1CNC(=O)c2cc(c(-c3ccsc3)n12)-c1cccc(OC(F)(F)F)c1
NCCC[C@H]1CNC(=O)c2cc(c(-c3ccc(O)cc3)n12)-c1cccc(OC(F)(F)F)c1
NCCC[C@H]1CNC(=O)c2cc(c(-c3ccc(CO)cc3)n12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
CN(C)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
CC(=O)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCCN)n12)-c1cccc(OC(F)(F)F)c1
CS(=O)(=O)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCCN)n12)-c1cccc(OC(F)(F)F)c1
CN(C)Cc1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCCN)n12)-c1cccc(OC(F)(F)F)c1
CN1CCN(Cc2ccc(cc2)-c2c(cc3C(=O)NC[C@H](CCCN)n23)-c2cccc(OC(F)(F)F)c2)CC1
CS(=O)(=O)NCC[C@H]1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cccc(OC(F)(F)F)c1
CC(=O)NCC[C@H]1CNC(=O)c2cc(c(-c3ccccc3)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc4OCOc4c3)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc4ccccc4c3)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc(cc3)S(N)(=O)=O)n12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1Cl)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
CCOc1ccc(cc1F)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
COc1c(C)cc(cc1C)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
CSc1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
CC(C)(C)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3cccc(c3)C(F)(F)F)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3cccc(F)c3)n12)-c1cccc(OC(F)(F)F)c1
Cc1cc(ccc1F)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
NCC[C@H]1CNC(=O)c2cc(c(-c3ccc(cc3)C3(N)CC3)n12)-c1cccc(OC(F)(F)F)c1
CN1CCN(Cc2ccc(cc2)-c2c(cc3C(=O)NC[C@H](CCCl)n23)-c2cccc(OC(F)(F)F)c2)CC1
CC(C)[C@H]1CNC(=O)c2cc(c(-c3ccc(CN)cc3)n12)-c1cccc(OC(F)(F)F)c1
Cc1cccc(c1)-c1c(cc2C(=O)NC[C@H](CCNC(N)=N)n12)-c1cccc(OC(F)(F)F)c1
CS(=O)(=O)c1ccc(cc1)-c1c(cc2C(=O)NC[C@H](CCNC(N)=N)n12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1F)-c1c(cc2C(=O)NC[C@H](CCN)n12)-c1cccc(OC(F)(F)F)c1
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
Fc1cccc(F)c1-c1ccc2cnc(Nc3cnccc3N3CCNCC3)n2n1
C1CN(CCN1)c1ccncc1Nc1ncc2ccc(nn12)-c1nccs1
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccc1Cl |r|
Clc1ccccc1-c1ccc2cnc(Nc3cnccc3N3CCNCC3)n2n1
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1cccnc1Cl |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1cccnc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1nccs1 |r|
Fc1cccc(F)c1-c1ccc2cnc(Nc3cnccc3OC3CNC3)n2n1
Clc1ccccc1-c1ccc2cnc(Nc3cnccc3O[C@@H]3CCCNC3)n2n1 |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccc(Cl)cc1Cl |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccc(F)cc1F |r|
N[C@H]1CCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ncncc1Nc1ncc2ccc(nn12)-c1ccccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccc1F |r|
Clc1ccccc1-c1ccc2cnc(Nc3cnccc3O[C@H]3CCCNC3)n2n1 |r|
O[C@@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccc1Cl |r|
O[C@@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1nccs1 |r|
O[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1nccs1 |r|
CS(=O)(=O)c1ccc(c(F)c1)-c1ccc2cnc(Nc3cnccc3N3CCC[C@H](N)C3)n2n1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1ccc(cc1F)S(C)(=O)=O |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(Cl)nn12 |r|
O[C@H]1CCN(C[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
CN(C)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
Nc1cccc(c1)-c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
Fc1cccc(F)c1-c1ccc2cnc(Nc3cnccc3-c3ccc(=O)[nH]c3)n2n1
Nc1cncc(c1)-c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
Nc1cc(ccn1)-c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
N[C@H]1CCCN(C1)c1sncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCC[C@H](C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
O[C@@H]1CCN(C[C@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ncncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1C[C@@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@@H]1CN(C[C@@H](N)[C@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
Cc1cc(N)cc(c1)-c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
N[C@H]1CN(CC[C@@H]1F)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@H]1F)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
NC1CN(CCC1F)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
C[C@H]1C[C@@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccc1F |r|
N[C@H]1C[C@@H](F)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CN([C@@H](C)CN1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1CN([C@@H](C)CN1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CN([C@H](C)CN1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
CC1CN(C(C)CN1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
N[C@H]1C[C@@H](F)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@@H]1[C@@H](N)CCCN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1[C@@H](N)CCCN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1[C@H](N)CCCN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1[C@H](N)CCCN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CN(CCN1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
CN[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1nccs1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccn1 |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ccccn1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1nnc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1nnc2ccccn12
N[C@@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1cc(ccc1F)C(=O)NC1CC1 |r|
N[C@H]1CCCN(C1)c1ccccc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1cc(ccc1F)C(=O)NC1CC1 |r|
C[C@H]1[C@@H](N)CCCN1c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@@H]1[C@@H](N)CCCN1c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
COC(C)CN(C)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
N[C@H]1CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1Cl |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1Cl |r|
N[C@H]1CCCN(C1)c1cnccc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCC(=C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r,c:5|
N[C@@H]1CCCC(=C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r,c:5|
NC1CCCC(=C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |c:5|
C[C@H]1CC[C@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1CC[C@@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1CC[C@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CC[C@@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
CN(C)C(=O)c1ccc(F)c(c1)-c1ccc2cnc(Nc3cnccc3N3CCC[C@H](N)C3)n2n1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1nnc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1Nc1nnc2ccc(nn12)-c1ncccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1Nc1nnc2ccc(nn12)-c1ncccc1F |r|
N[C@@H]1C=C(CC[C@H]1F)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r,c:2|
C[C@H]1CC[C@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@@H]1CC[C@@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@@H]1CC[C@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@H]1CC[C@@H](N)CN1c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
C[C@H]1CCN(C[C@H]1N)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1CCN(C[C@@H]1N)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@@H]1CCN(C[C@H]1N)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
C[C@H]1CCN(C[C@@H]1N)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
Cc1oncc1-c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F
C[C@]1(N)CCCN(C1)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
Fc1cccc(F)c1-c1ccc2cnc(Nc3cnccc3C3=CCNCC3)n2n1 |t:24|
Cc1noc(C)c1-c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |(.7,.38,;2.04,-.39,;2.51,-1.85,;4.05,-1.85,;4.53,-.39,;5.86,.38,;3.28,.52,;3.28,2.06,;4.62,2.83,;4.62,4.37,;3.28,5.14,;1.95,4.37,;1.95,2.83,;.62,2.06,;-.72,2.83,;-1.34,4.23,;-2.88,4.07,;-3.2,2.56,;-4.53,1.79,;-4.53,.25,;-3.2,-.52,;-1.86,.25,;-1.86,1.79,;-3.2,-2.06,;-1.86,-2.83,;-.53,-2.06,;-1.86,-4.37,;-3.2,-5.14,;-4.53,-4.37,;-4.53,-2.83,;-5.86,-2.06,)|
CSc1nccc(n1)-c1cc(nn1C1CCNCC1)C(N)=O
CC1CCCCN1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCC(F)(F)CC3)c2c1
CC1CCCCN1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(NC4CCCC4)n3)c2c1
CC(C)Nc1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3ccc(F)cc3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)-c3ccccc3F)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3ccccc3F)c2n1
COc1cncc(c1)-c1c[nH]c2ccc(nc12)-c1nnc(N)o1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCOCC3)c2c1
NCCCNc1nnc(s1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CN1CCN(CC1)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCCC3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(NC4CC4)n3)c2c1
c1cc(nc(c1)NC2CCCC2)c3c[nH]c4c3cc(cc4)c5nnc(s5)N
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(NC4CCCC4)n3)c2c1
CN1CCN(CC1=O)c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CCOc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1ncc(s1)-c1ccc2[nH]cc(-c3cnc4ccccc4c3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cnc4ccccc4c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(c3)-c3ccccc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccc(F)cc3F)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
Cc1nnc2CN(CCn12)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Oc1nnc(s1)-c1ccc2[nH]cc(-c3ccc(F)cc3F)c2c1
Brc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
C1CN(CCO1)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nncs1
Oc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
CN1CCN(CC1=O)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-c3ccc(Cl)cc3)c2c1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC2CCCNC2)s1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(s1)N1CC[C@@H](N)C1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(s1)N1CC[C@H](N)C1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N[C@@H]2CCCNC2)s1
COc1ccc(CNc2nnc(o2)-c2ccc3[nH]cc(-c4cncc(n4)C4CC4)c3c2)cc1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)N1CCCC1
O=c1[nH]nc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)-c1ccn[nH]1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(Nc2ccccc2)o1
CNc1nnc(o1)-c1ccc2[nH]cc(-c3cccc(OC(C)C)n3)c2c1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(C)o1
C1CC1c1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
C1CC1c1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1
CC(C)c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NCC#N)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nc(cc(n3)C(O)=O)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nc(cc(n3)C(N)=O)C3CC3)c2c1
C1CC1Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1
CC(C)(Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1)c1ccccc1
CC(C)Cc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
CC(C)(Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncccn3)c2c1)c1ccccc1
FC(F)(F)CNc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
CC(C)(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
COc1nc(ncc1F)-c1cn(c2ccc(cc12)-c1nnc(NC(C)(C)C)o1)S(=O)(=O)c1ccc(C)cc1
CC(C)(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncc(F)c(n3)C3CC3)c2c1
CCc1nc(ncc1F)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)(C)C)o1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(s1)-c1ccccc1
COc1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(OC(C)C)n3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCN(C)C(=O)C3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(OC4CCCN(C)C4)n3)c2c1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nc(N)ns1
CC(C)Nc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nc(N)ns1
CC(C)Nc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nsc(N)n1
CC(C)Nc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nc(N)no1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nc(N)no1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1noc(N)n1
CC(C)Nc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1noc(N)n1
CC(C)Oc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1noc(N)n1
CNc1nc(no1)-c1ccc2[nH]cc(-c3cncc(OC(C)C)n3)c2c1
CC(C)Nc1nc(no1)-c1ccc2[nH]cc(-c3cncc(OC(C)C)n3)c2c1
CC(C)Oc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1noc(NC(C)=O)n1
CN1CCN(CC1)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CC(C)Oc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cccc(n3)-n3cccn3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cccc(F)c3F)c2c1
CC(C)Oc1cc(F)cc(c1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CC(C)Cn1cc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cnn(CCN4CCOCC4)c3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(c3)C(=O)N3CCOCC3)c2c1
CC(C)Oc1ccc(F)c(c1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CC(C)Oc1cccc(c1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CCOc1cnc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCC(F)(F)C3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCCCC3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCOCC3)c2c1
C[C@H]1COCCN1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1 |r|
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(Oc4ccccc4)n3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncccn3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cc(ncn3)C(F)(F)F)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C(F)(F)F)c2c1
CC1CCCN1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(O[C@@H]4CCCNC4)n3)c2c1 |r|
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(NCC4CC4)n3)c2c1
CC(C)Nc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(Cl)n3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCC[C@@H](O)C3)c2c1 |r|
C[C@H]1CCCN(C1)c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1 |r|
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(Oc4ccccc4)n3)c2c1
CN(C)[C@H]1CCCN(C1)c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1 |r|
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(Nc4ccccc4)n3)c2c1
COC[C@@H]1CCCN1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1 |r|
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(OCC(F)(F)F)n3)c2c1
CN1CCCC(C1)Nc1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CN1CCCC(C1)Oc1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
COC[C@H]1CCCN1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1 |r|
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3ccc(Cl)cc3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3ccccc3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3ccccc3F)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3ccccc3Cl)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)-c3ccccc3Cl)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3cccc(F)c3)c2c1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)-c3cccc(Cl)c3)c2c1
Cn1cc(cn1)-c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)-c3ccccc3)c2c1
Cc1ccccc1-c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CC(C)Oc1ccc(F)c(c1)-c1c[nH]c2ccc(nc12)-c1nnc(N)o1
CC(C)Oc1cccc(c1)-c1c[nH]c2ccc(nc12)-c1nnc(N)o1
CC(C)Cn1cc(cn1)-c1c[nH]c2ccc(nc12)-c1nnc(N)o1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCC[C@H](N)C3)c2c1 |r|
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccnc(n3)N3CCOCC3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-c3ccccc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3nccc(n3)-c3ccccc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCN(C)CC3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3ccnc(n3)N3CCOCC3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCOCC3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3nccc(n3)N3CCCCC3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cc(ccc3F)C(=O)Nc3ccccc3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3c(F)cccc3F)c2c1 |(-7.36,1.9,;-6.13,2.04,;-5.37,3.37,;-3.86,3.05,;-3.71,1.53,;-5.1,.89,;-2.38,.77,;-2.38,-.77,;-1.03,-1.55,;.3,-.77,;1.76,-1.24,;2.66,.02,;1.76,1.24,;2.23,2.7,;1.29,3.91,;.07,3.74,;1.86,5.34,;3.38,5.55,;4.33,4.34,;3.76,2.91,;4.52,1.94,;.3,.77,;-1.03,1.55,)|
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1nnc(N[C@H]2CCCNC2)s1 |r|
N[C@H]1CCN(C1)c1nnc(s1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1 |r|
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1nnc(NCC[C@H]2CCCCN2)s1 |r|
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1nnc(NCc2ccc3[nH]ccc3c2)s1
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1nnc(NCc2cccc3[nH]ccc23)s1
NC1CCN(CC1)c1nnc(s1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CC(=O)Nc1cccc(CNc2nnc(s2)-c2ccc3[nH]cc(-c4ccccc4F)c3c2)c1
COCC(=O)Nc1cccc(CNc2nnc(s2)-c2ccc3[nH]cc(-c4ccccc4F)c3c2)c1
Cc1[nH]c2ccc(CNc3nnc(s3)-c3ccc4[nH]cc(-c5ccc(F)cc5F)c4c3)cc2c1C
CC(=O)Nc1ccc(CNc2nnc(s2)-c2ccc3[nH]cc(-c4ccc(F)cc4F)c3c2)cc1
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1nnc(NCc2ccccc2)s1
CNc1ccc(CNc2nnc(s2)-c2ccc3[nH]cc(-c4ccc(F)cc4F)c3c2)cc1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3ccc4nccnc4c3)c2c1
N[C@H]1CCCCN1c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1 |r|
C[C@H]1CCCCN1c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1 |r|
CCN(CC)c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Cc1cn(cn1)-c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCOCC3)c2c1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CN(C)c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CC(C)Oc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(OC4CCCC4)n3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(OC4CCC4)n3)c2c1
CC1CCN(CC1)c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(OC4CCCC4)n3)c2c1
CCOc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CCCOc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCCC3=O)c2c1
COc1ccc(nc1OC)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Cc1nccn1-c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Cc1cn(cn1)-c1nc(cs1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3ccc4cn[nH]c4c3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCCCC3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(OC4CCCCC4)n3)c2c1
C[C@@H]1CCCN(C1)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1 |r|
CC1CCN(CC1)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3csc(n3)-n3ccccc3=O)c2c1
CN1CCN(CC1)c1cnc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Cc1ccn(n1)-c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-n3cccn3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCCCC3=O)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)C(F)(F)F)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)C#N)c2c1
C[C@H]1CCCCN1c1nc(cs1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1 |r|
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-n3ccccc3=O)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3ccnc(N)c3)c2c1
CCN(C)c1cnc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cnc(cn3)N3CCCC3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(N)n3)c2c1
Cc1nc(ccc1F)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cnc(cn3)N3CCOCC3)c2c1
CCCCOc1cnc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cnc(cn3)N3CCCC3=O)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cnc(OC4CCCC4)cn3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(O)n3)c2c1
Cc1ccn(n1)-c1cnc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCCCC3)c2c1
COc1cncc(c1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
COc1cc(nc(OC(C)C)n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CC1(C)CNc2ncc(nc12)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
COc1cc(nc(NC(C)C)n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CC(C)Nc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(NCC4CC4)n3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(NC4CCCCC4)n3)c2c1
CC(C)Nc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(NCC4CC4)n3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(NC4CCCCC4)n3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(F)n3)c2c1
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(N)n3)c2c1
CC(Oc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1)C(F)(F)F
COc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
CS(=O)(=O)c1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccc4CC(C)(C)Oc4c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cnc4ccccc4c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cn[nH]c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccncc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccnc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(N)c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccn[nH]3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccccc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(c3)C(F)(F)F)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(OC(F)(F)F)c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(OC)c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCCCC3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-n3cnc(C)c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCCC3=O)c2c1
CCOc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC)s1
CCc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(n3)N(C)C)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(OC4CCC4)n3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3csc(n3)-n3cnc(C)c3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-n3ccnc3C)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCCCC3=O)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3c(F)cccc3F)c2c1 |(5.9,-3.36,;4.41,-2.96,;4.01,-1.47,;4.91,-.23,;4.01,1.02,;2.55,.54,;2.55,-1,;1.21,1.31,;1.21,2.85,;-.12,3.62,;-1.46,2.85,;-2.92,3.33,;-3.83,2.08,;-2.92,.84,;-3.32,-.65,;-4.81,-1.05,;-5.9,.04,;-5.21,-2.54,;-4.12,-3.62,;-2.63,-3.23,;-2.23,-1.74,;-.74,-1.34,;-1.46,1.31,;-.12,.54,)|
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)-n3ccccc3=O)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(F)n3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3csc(n3)-c3ccoc3)c2c1
CNc1nnc(s1)-c1ccc2[nH]cc(-c3ccc(s3)-c3cccs3)c2c1
NC(=O)c1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
CSc1nnc(s1)-c1ccc2[nH]cc(-c3cccc(n3)N3CCOCC3)c2c1
CC(C)Oc1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnco1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)N1CCOCC1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)N1CCNCC1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC2CNC2)o1
C[C@H]1COCCN1c1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1 |r|
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC2COC2)o1
CC[C@@H]1COCCN1c1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1 |r|
CC1(C)COCCN1c1nnc(o1)-c1ccc2[nH]cc(-c3cncc(n3)C3CC3)c2c1
C1CC1c1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)-c1ccccc1
C1CC1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)-c1ccccc1
C1CC1c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC2COC2)o1
C1CC1Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C(F)(F)F)c2c1
CCOc1nc(ncc1F)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
COc1nc(nc(C)c1F)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C(C)=O)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncc(F)c(n3)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nc(n[nH]3)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C3CC3)c2c1
CC(Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncccn3)c2c1)c1ccccc1
CC(Nc1nnc(o1)-c1ccc2[nH]cc(-c3ccccn3)c2c1)c1ccccc1 |w:1.0|
CC(Nc1nnc(o1)-c1ccc2[nH]cc(-c3cnccn3)c2c1)c1ccccc1
Fc1cccc(Nc2nnc(o2)-c2ccc3[nH]cc(-c4nccc(n4)C4CC4)c3c2)c1
Cc1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)(C)C)o1
CC(C)(C)Nc1nnc(o1)-c1ccc2[nH]cc(C3=CCOCC3)c2c1 |t:18|
Cc1cc(N)nc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)(C)C)o1
CC(C)(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C(N)=O)c2c1
Cc1cncc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(o1)-c1ccccc1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncc(s3)C(=O)NC3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncc(s3)C(N)=O)c2c1
CC(C)(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncc(s3)C(N)=O)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nc(cs3)C(=O)NC3CC3)c2c1
CC(C)Nc1nnc(o1)-c1cc2c(c[nH]c2cc1F)-c1nccc(n1)C1CC1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ncc(C(N)=O)c(n3)C3CC3)c2c1
CNC(=O)c1ccnc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3nccc(n3)C(=O)NC3CC3)c2c1
CS(=O)(=O)c1ccc(nc1)-c1c[nH]c2ccc(cc12)-c1nnc(N)o1
CNC(=O)c1cccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CNC(=O)c1cncc(c1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ccnc(NC(C)C)n3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3cc(=O)[nH]c(NC(C)C)n3)c2c1
CNC(=O)c1ncc(F)c(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CNC(=O)c1ccc(F)c(c1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(NC(=O)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3cccc(n3)C(=O)N(C)C)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(c3)C(=O)N(C)C)c2c1
COc1nccc(n1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
COc1nc(cc(=O)[nH]1)-c1c[nH]c2ccc(cc12)-c1nnc(NC(C)C)o1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3cncc(c3)C(=O)NC3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3cc(=O)[nH]c(n3)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(-c3ccnc(n3)C3CC3)c2c1
CC(C)Nc1nnc(o1)-c1ccc2[nH]cc(NC(=O)c3ccncc3)c2c1
Clc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Nc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Cc3ccccc3)nc12
CN(c1ccccc1)c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Sc3ccccc3)nc12
Fc1ccccc1Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Fc1cccc(Cl)c1Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Fc1ccc(Nc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c(F)c1
Fc1cccc(Cl)c1Oc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Fc1ccc(Oc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c(F)c1
Fc1ccccc1Oc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Fc1cccc(Cl)c1Nc1ccc2cccc(-c3cc4c(cc[nH]c4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Nc3cncnc3)nc12
CCN(c1ccccc1)c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Clc1ccc(Nc2ccc3cccc(-c4cc5c(nc[nH]c5=O)[nH]4)c3n2)cc1
O=c1[nH]cnc2[nH]c(cc12)-c1cccc2ccc(Nc3ccccc3)nc12
O=c1[nH]cnc2[nH]c(cc12)-c1cccc2ccc(Oc3ccccc3)nc12
Clc1ccc(Oc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)cc1
Clc1ccc2cccc(-c3cc4c(nc[nH]c4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(OCc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(NCc3ccccc3)nc12
CCC1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Cl)nc12
CCC1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Oc3ccccc3)nc12
CCC1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Nc3ccccc3)nc12
CC[C@@H]1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Nc3ccccc3)nc12
CC1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Cl)nc12
CC1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Oc3ccccc3)nc12
CC1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Nc3ccccc3)nc12
CCN(c1cccnc1)c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1Cc2[nH]c(cc2C(=O)N1)-c1cccc2ccc(Nc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Oc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Nc3cccnc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(Oc3cccnc3)nc12
Clc1cccc(Nc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
Clc1cccc(Oc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
Fc1cccc(Oc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
Cc1cccc(Oc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
Cc1cccc(Nc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
Fc1cccc(Nc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
COC(=O)N(c1ccccc1)c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(NC3CCCC3)nc12
CC(Oc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)C(F)(F)F
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(OC3CCCC3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(OC3CCNCC3)nc12
O[C@H]1CC[C@@H](CC1)Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1 |r,wU:4.7,wD:1.0,(5.33,-9.24,;5.33,-7.7,;6.67,-6.93,;6.67,-5.39,;5.33,-4.62,;4,-5.39,;4,-6.93,;5.33,-3.08,;4,-2.31,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;,-3.08,;,-4.62,;-1.25,-5.53,;-.77,-6.99,;.77,-6.99,;1.54,-8.32,;.77,-9.66,;-.77,-9.66,;-1.54,-8.32,;-3.08,-8.32,;1.25,-5.53,;1.33,-2.31,;2.67,-3.08,)|
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(NC3CCCCC3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(nc12)N1CCOCC1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(NC3CCOCC3)nc12
CS(=O)(=O)c1ccc(c(F)c1)-c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Nc1ccc(c(F)n1)-c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
COc1ccc(Cl)cc1-c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(O[C@@H]3CCCNC3)nc12
Nc1ccc(c(F)c1)-c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(O[C@H]3CCCNC3)nc12
Cc1cccc(C)c1Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Clc1ccccc1Oc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Cc1cc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Oc1ccccc1
Cc1cc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Nc1ccccc1
Cc1cc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Nc1ccc(Br)cc1
Clc1ccccc1Nc1ccc2cccc(-c3cc4c(cc[nH]c4=O)[nH]3)c2n1
Clc1ccccc1Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Oc1cccc(Oc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
Nc1cccc(Nc2ccc3cccc(-c4cc5c(CCNC5=O)[nH]4)c3n2)c1
C[C@@H](Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)c1ccccc1
C[C@H](Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)c1ccccc1
C=C(c1ccccc1)c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(nc12)C1(CC1)c1ccccc1
CC(c1ccccc1)c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CCC1CNC(=O)c2cc([nH]c12)-c1cccc2cc(C)c(Nc3ccccc3)nc12
O=C1NCC(Cc2ccccc2)c2[nH]c(cc12)-c1cccc2cccnc12
N[C@@H]1CCC[C@H](C1)Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
N[C@H]1CCC[C@H](C1)Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(N[C@H]3CCCNC3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(N[C@@H]3CCCNC3)nc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1F
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCOCC1
C[C@@H](Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C(N)=O
C[C@H](Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C(N)=O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N1CCOCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCCCC1
CC(=C)CNc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
COC(=O)[C@H](C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
COC(=O)[C@@H](C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N1CCCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N1CCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CCC[C@H](N)C1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CC[C@H](N)C1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CC(F)(F)C1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(CO)CCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NCC(C)(C)C
O=C1NCCn2cc(cc12)-c1cccc2ccc(Nc3ccccc3)nc12
O=C1NCCn2cc(cc12)-c1cccc2ccc(Nc3cccnc3)nc12
O=C(N1CCOCC1)c1ccc2cccc(-c3cc4C(=O)NCCn4c3)c2n1
Fc1cccc(F)c1Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Fc1cccc(F)c1Oc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=C1NCCc2[nH]c(cc12)-c1cccc2ncc(Oc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ncc(Nc3ccccc3)nc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Nc1ccccc1
CCN(c1ccccc1)c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1CNC(=O)c2cc([nH]c12)-c1cccc2ncc(Nc3ccccc3)nc12
CN(c1ccccc1)c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
O=c1[nH]ccc2[nH]c(nc12)-c1cccc2ccc(Nc3ccccc3)nc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Nc1ccccn1
CCCNc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CC(C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CC1
CN1CC(CCC1=O)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1COC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)COC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCOC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCC(=O)NC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCNC1=O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CO
O=c1[nH]ccc2[nH]c(cc12)-c1cccc2ccc(Oc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(nc12)-c1ccccc1
Fc1ccc2ccc(Nc3ccccc3)nc2c1-c1cc2c(CCNC2=O)[nH]1
Fc1ccc2ccc(Nc3cccnc3)nc2c1-c1cc2c(CCNC2=O)[nH]1
Cn1cc(cn1)-c1ccc2ccc(F)c(-c3cc4c(CCNC4=O)[nH]3)c2n1
Fc1cccc(F)c1-c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Cc1ccc(cc1-c1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)C(N)=O
Cc1nc2cccc(-c3cc4C(=O)NCCn4c3)c2nc1NC1CC1
O=C1NCCc2[nH]c(cc12)-c1cccc2cnc(Oc3ccccc3)nc12
CC[C@H]1CNC(=O)c2cc([nH]c12)-c1cccc2ccc(Nc3ccccc3)nc12
O=C1NCCc2[nH]c(cc12)-c1cccc2cnc(nc12)C1(CC1)c1ccccc1
O=C1NCCc2[nH]c(cc12)-c1cccc2cnc(Nc3ccccc3)nc12
Nc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Oc1ccccc1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCN(CC1)C(=O)OC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CCN(C1)C(=O)OC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1CCN(C1)C(=O)OC(C)(C)C
CC(=O)N1CCC(CC1)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1CCCN(C1)C(=O)OC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CCCN(C1)C(=O)OC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCNCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CC[C@@H]1N
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1CCNC1
CC(=O)N[C@@H]1CC[C@@H]1Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
COC(=O)C(C)(C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C(O)=O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CCNC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C(N)=O
COCC(C)(C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CC(=O)N1CC[C@H](C1)Nc1nc(C(=C)c2cc3c(CCNC3=O)[nH]2)c(C)nc1C
CC(=O)N1CC[C@@H](C1)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CC(C)CNc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CCCC1
CC(C)N(C)c1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CCNc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NCC(C)(C)N
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCOC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CC(O)C1 |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;8.16,-.37,;8.55,-1.86,;9.89,-2.63,;7.07,-2.26,)|
CC(C)C(C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCS(=O)(=O)C1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1CCCNC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1CCCNC1
Cc1nc2cccc(-c3cc4c([nH]3)C3(CC3)CNC4=O)c2nc1NC1CC1
O=C1NCCc2[nH]c(cc12)-c1cccc2ccc(NC3CC3)nc12
Cc1nc2cccc(-c3cc4C(=O)NCCn4c3)c2nc1NC1(C)CC1
CC(C)CC1CNC(=O)c2cc([nH]c12)-c1cccc2cccnc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NCC(C)(C)O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CN(C1)C(=O)OC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CNC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1OC1CCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1OCC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CCCCC1
CC1CNC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(F)nc12
CCCCNc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1cnc2cccc(-c3cc4C(=O)NCCn4c3)c2n1
Cc1nc2cccc(-c3cc4C(=O)NCCn4c3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CCOCC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCC(O)C1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1CCCCC1O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1CC[C@H](O)CC1 |wU:22.25,wD:25.29,(3.76,-3.27,;2.43,-2.5,;1.1,-3.27,;-.24,-2.5,;-1.57,-3.27,;-2.91,-2.5,;-2.91,-.96,;-1.57,-.19,;-1.57,1.35,;-.33,2.26,;-.8,3.72,;-2.34,3.72,;-3.11,5.05,;-2.34,6.39,;-.8,6.39,;-.03,5.05,;1.51,5.05,;-2.82,2.26,;-.24,-.96,;1.1,-.19,;2.43,-.96,;3.76,-.19,;5.1,-.96,;6.43,-.19,;7.76,-.96,;7.76,-2.5,;9.1,-3.27,;6.43,-3.27,;5.1,-2.5,)|
CC(C)(C)Nc1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1(CC1)Nc1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1(C)CCCCN1c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1(C)COCCN1c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1(C)CN(CCN1)c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CN(c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)C(C)(C)C
CC1(C)CCCN1c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC1(C)CNCCN1c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N
CNc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CCN(c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)C(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1SC(C)(C)C
CN(c1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C(C)(C)C
CC1(C)CCN1c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC(C)(C)Nc1nc2c(cccc2nc1C(F)(F)F)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4C(=O)NCC(CCO)n4c3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NS(C)(=O)=O
CC(=O)N1CCC[C@H](C1)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CC(=O)N1CCC[C@@H](C1)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
CN1CC(C1)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C(F)(F)F
C[C@H](Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C(F)(F)F
C[C@@H](Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C(F)(F)F
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(CC1)C(F)(F)F
Cc1nc2cccc(-c3cc4c(nc[nH]c4=O)[nH]3)c2nc1NC1CCC1
Cc1nc2cccc(-c3cc4c(nc[nH]c4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(nc[nH]c4=O)[nH]3)c2nc1N
Cc1nc2cccc(-c3cc4c(nc[nH]c4=O)[nH]3)c2nc1NC(C)(C)CO
Cc1nc2cccc(-c3cc4c(nc[nH]c4=O)[nH]3)c2nc1F
CSc1nc2c(cccc2c(=O)n1C)-c1cc2c(CCNC2=O)[nH]1
Cn1c(Nc2ccccc2)nc2c(cccc2c1=O)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1OCCC(C)(C)N
C[C@H](Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C1CC1
C[C@@H](Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)C1CC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1CC(C)(C)C
Cc1nc2cccc(-c3cc4c([nH]3)C(Cc3ccc(Cl)cc3)CNC4=O)c2nc1N
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CS(C)(=O)=O
COc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(CO)CC1
CC#CCC1CNC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CCO
CC#CCC1CNC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(F)nc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NCC1(C)COC1
CC(C)(C)Nc1nc2c(cccc2nc1C=O)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2nccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
CC(C)(C)Nc1nc2c(cccc2nc1N)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2[nH]c1=O)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NCC1(C)CC1
CC(C)Nc1nc2c(cccc2nc1C)-c1cc2C(=O)N[C@H](C)c2[nH]1
C[C@H]1Cc2[nH]c(cc2C(=O)N1)-c1cccc2nc(C)c(NC(C)(C)C)nc12
C[C@@H]1Cc2[nH]c(cc2C(=O)N1)-c1cccc2nc(C)c(NC(C)(C)C)nc12
Cc1nc2cccc(-c3cc4c(CCNC4=O)n3C(=O)OC(C)(C)C)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCN(C(=O)OC(C)(C)C)C4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=S)[nH]3)c2nc1NC(C)(C)C
C[C@@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NCC(F)(F)F)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NCC(F)(F)F)nc12
Cc1nc2ccc(F)c(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NC(C)(C)C
Cc1nc2ccc(F)c(-c3cc4C(=O)NCc4[nH]3)c2nc1NC(C)(C)C
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2nc(C)c(NC(C)(C)C)nc12
C[C@@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2nc(C)c(NC(C)(C)C)nc12
Cc1nc2cccc(-c3cc4c(CCN(CO)C4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCN\C4=N\O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)NCc4[nH]3)c2nc1NCC(F)(F)F
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC(C)(C)CO)nc12
Cc1nc2cccc(-c3cc4c(CCCC4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCCNC4=O)[nH]3)c2nc1NC(C)(C)C
CC(C)(C)Nc1nc2c(cccc2nc1CO)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2nc1C#C)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2nc1\C=N\O)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2nc1C#N)-c1cc2c(CCNC2=O)[nH]1
C[C@H](O)c1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
C[C@@H](O)c1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
CCc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)n3C)c2nc1NC(C)(C)C
CC(=O)N1CCc2[nH]c(cc2C1=O)-c1cccc2nc(C)c(NC(C)(C)C)nc12
CC1N(C(=O)OC(C)(C)C)C(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
COCCOCC(C)(C)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N1CC(C1)S(C)(=O)=O
CC(Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)c1ccccn1
CC(Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)c1cnccn1
CC(Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1)c1ccncn1
Cc1nc2cccc(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NC1CC1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
C[C@@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
C[C@@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC3(C)CC3)nc12
Cc1nc2cccc(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NC1(C)CC1
CC(C)Nc1nc2c(-c3cc4C(=O)NC5(CC5)c4[nH]3)c(F)ccc2nc1C
Cc1nc2cccc(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NCC(F)F
C[C@H]1NC(=S)c2cc([nH]c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NC3(C)CC3)nc12
Cc1nc2cccc(-c3cc4C(=O)NCc4[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NCC(F)(F)F
CCOc1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CCS(C)(=O)=O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CNC(=O)OC(C)(C)C
CC(C)(C)Nc1ccc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CN
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CNCCS(C)(=O)=O
CC(C)(C)Nc1nc2c(cccc2nc1F)-c1cc2c(CCNC2=O)[nH]1
CNc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
CC(C)(C)Nc1nc2c(cccc2nc1Cl)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2nc1N1CC(O)C1)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2nc1N1CCC1)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3[nH]c4CCNC(=O)c4c3Cl)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3[nH]c4CCNC(=O)c4c3Br)c2nc1NC(C)(C)C
Cc1c([nH]c2CCNC(=O)c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
COC1=NCCc2[nH]c(cc12)-c1cccc2nc(C)c(NC(C)(C)C)nc12 |t:2|
C[C@@H](O)[C@@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2nc(C)c(NC3CC3)nc12
C[C@H](O)[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2nc(C)c(NC3CC3)nc12
Cc1nc2cccc(-c3cc4C(=O)NC(COCc5ccccc5)c4[nH]3)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3cc4C(=O)NCc4[nH]3)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3[nH]c4CNC(=O)c4c3Cl)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3cc4C(=O)NC(CO)c4[nH]3)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3cc4C(=O)N[C@H](CO)c4[nH]3)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3cc4C(=O)N[C@@H](CO)c4[nH]3)c2nc1NC1(C)CC1
Cc1nc2cccc(-c3cc4C(=O)NCc4[nH]3)c2nc1NC1CC1
Cc1nc2cccc(-c3cc4C(=O)NC(COCc5ccccc5)c4[nH]3)c2nc1NC1CC1
Cc1nc2cccc(-c3cc4C(=O)NC(CO)c4[nH]3)c2nc1NC1CC1
Cc1nc2cccc(-c3cc4C(=O)N[C@H](CO)c4[nH]3)c2nc1NC1CC1
Cc1nc2cccc(-c3cc4C(=O)N[C@@H](CO)c4[nH]3)c2nc1NC1CC1
Cc1nc2ccnc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2ccc(F)c(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CC1
Cc1nc2ccc(F)c(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CO
Cc1nc2ccc(F)c(-c3cc4c(cc[nH]c4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nnc(o1)-c1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
CC(C)Nc1nc2c(-c3cc4c(CCNC4=O)[nH]3)c(F)ccc2nc1C
CC(C)(C)Nc1ncc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CCC(C)(C)Nc1nc2c(-c3cc4c(CCNC4=O)[nH]3)c(F)ccc2nc1C
Cc1nc2ccc(F)c(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC1(C)CCC1
CN(c1ncc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1)C(C)(C)C
Cc1nc2ccc(F)c(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NC1(C)CC1
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2nc(C)c(NC3(C)CC3)nc12
C[C@@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2nc(C)c(NC3(C)CC3)nc12
Cc1nc2cccc(-c3cc4C(=O)NC5(CC5)c4[nH]3)c2nc1NCC(F)(F)F
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NCC(F)F)nc12
C[C@@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(NCC(F)F)nc12
Cc1cccc(C)c1-c1cnc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2n1
CC(C)Nc1nc2c(cccc2c(=O)n1-c1ccccc1)-c1cc2c(CCNC2=O)[nH]1
CC(C)Nc1nc2c(cccc2c(=O)n1-c1cccnc1)-c1cc2c(CCNC2=O)[nH]1
CC(C)(C)Nc1nc2c(cccc2c(=O)n1-c1cccnc1)-c1cc2c(CCNC2=O)[nH]1
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2c1nc(NC(C)(C)C)n(C)c2=O
CC(C)n1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc([nH]c2=O)N(C)C(C)(C)C
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)[nH]c2=O
Cc1nc2cccc(-c3cc4C(=O)NC5(CCOCC5)c4[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1cccnc1Cl
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccncc1Cl
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1cnccc1Cl
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccc(N)cc1Cl
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1c(F)cccc1Cl |(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;6.67,-2.31,;8,,;8,1.54,;6.67,2.31,;5.33,1.54,;4,2.31,)|
CC(C)Nc1nc2c(cccc2c(=O)n1-c1ccccn1)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c([nH]3)c(C)n[nH]c4=O)c2nc1NC(C)(C)C
Cc1[nH]c(cc1C(N)=O)-c1c(F)ccc2nc(C)c(NC3(C)CC3)nc12
Cc1nc2cccc(-c3cc(C(N)=O)c([nH]3)C3CC3)c2nc1NC(C)(C)C
Cn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)NCc2[nH]1
Cc1nc2cccc(-c3c[nH]c(c3)C(N)=O)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4CNC(=O)n4c3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)NC(=O)n4c3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(cn[nH]c4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccccc1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1Cl
Cc1ccccc1-c1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccccc1Cl
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccccc1F
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccccn1
Cc1cccnc1-c1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1ccoc1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1-c1nccn1C
Cc1occc1-c1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1C[C@@H](C1)NC(=O)OC(C)(C)C |r,wU:22.25,24.30,(-2.13,1.6,;-1.36,.27,;-2.13,-1.07,;-1.36,-2.4,;-2.13,-3.74,;-1.36,-5.07,;.18,-5.07,;.95,-3.74,;2.49,-3.74,;3.4,-4.98,;4.86,-4.51,;4.86,-2.97,;6.2,-2.2,;7.53,-2.97,;7.53,-4.51,;6.2,-5.28,;6.2,-6.82,;3.4,-2.49,;.18,-2.4,;.95,-1.07,;.18,.27,;.95,1.6,;.18,2.93,;.58,4.42,;-.91,4.82,;-1.31,3.33,;-1.68,6.15,;-3.22,6.15,;-3.99,4.82,;-3.99,7.49,;-5.53,7.49,;-7.07,7.49,;-5.53,9.03,;-5.53,5.95,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1C[C@H](N)C1 |r,wU:24.28,22.25,(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;7.07,-2.26,;8.55,-1.86,;9.89,-2.63,;8.16,-.37,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1C[C@@H](C1)NC(=O)OC(C)(C)C |r,wU:22.25,wD:24.30,(-2.13,1.6,;-1.36,.27,;-2.13,-1.07,;-1.36,-2.4,;-2.13,-3.74,;-1.36,-5.07,;.18,-5.07,;.95,-3.74,;2.49,-3.74,;3.4,-4.98,;4.86,-4.51,;4.86,-2.97,;6.2,-2.2,;7.53,-2.97,;7.53,-4.51,;6.2,-5.28,;6.2,-6.82,;3.4,-2.49,;.18,-2.4,;.95,-1.07,;.18,.27,;.95,1.6,;.18,2.93,;-1.31,3.33,;-.91,4.82,;.58,4.42,;-1.68,6.15,;-3.22,6.15,;-3.99,4.82,;-3.99,7.49,;-5.53,7.49,;-7.07,7.49,;-5.53,9.03,;-5.53,5.95,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1C[C@H](N)C1 |r,wU:22.25,wD:24.28,(11.05,-3.7,;9.72,-2.93,;8.39,-3.7,;7.05,-2.93,;5.72,-3.7,;4.39,-2.93,;4.39,-1.39,;5.72,-.62,;5.72,.92,;6.97,1.82,;6.49,3.29,;4.95,3.29,;4.18,4.62,;4.95,5.96,;6.49,5.96,;7.26,4.62,;8.8,4.62,;4.47,1.82,;7.05,-1.39,;8.39,-.62,;9.72,-1.39,;11.05,-.62,;12.39,-1.39,;13.88,-.99,;14.27,-2.48,;15.61,-3.25,;12.79,-2.88,)|
CC(C)(C)Nc1nc2c(cccc2nc1-c1ccccc1)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1C[C@H](O)C1 |wU:24.28,22.25,(4.32,-3.45,;2.98,-2.68,;1.65,-3.45,;.32,-2.68,;-1.02,-3.45,;-2.35,-2.68,;-2.35,-1.14,;-1.02,-.37,;-1.02,1.17,;.23,2.08,;-.25,3.54,;-1.79,3.54,;-2.56,4.88,;-1.79,6.21,;-.25,6.21,;.52,4.88,;2.06,4.88,;-2.26,2.08,;.32,-1.14,;1.65,-.37,;2.98,-1.14,;4.32,-.37,;5.65,-1.14,;6.05,-2.62,;7.54,-2.23,;8.87,-3,;7.14,-.74,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1C[C@@H](C1)NCCS(C)(=O)=O |wU:24.30,22.25,(3.1,-2.95,;1.77,-2.18,;.43,-2.95,;-.9,-2.18,;-2.23,-2.95,;-3.57,-2.18,;-3.57,-.64,;-2.23,.13,;-2.23,1.67,;-.99,2.58,;-1.46,4.04,;-3,4.04,;-3.77,5.37,;-3,6.71,;-1.46,6.71,;-.69,5.37,;.85,5.37,;-3.48,2.58,;-.9,-.64,;.43,.13,;1.77,-.64,;3.1,.13,;4.43,-.64,;4.83,-2.13,;6.32,-1.73,;5.92,-.24,;7.65,-2.5,;8.99,-1.73,;10.32,-2.5,;11.65,-1.73,;10.88,-.39,;12.99,-.96,;12.42,-3.06,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1C[C@H](O)C1 |wU:22.25,wD:24.28,(4.32,-3.45,;2.98,-2.68,;1.65,-3.45,;.32,-2.68,;-1.02,-3.45,;-2.35,-2.68,;-2.35,-1.14,;-1.02,-.37,;-1.02,1.17,;.23,2.08,;-.25,3.54,;-1.79,3.54,;-2.56,4.88,;-1.79,6.21,;-.25,6.21,;.52,4.88,;2.06,4.88,;-2.26,2.08,;.32,-1.14,;1.65,-.37,;2.98,-1.14,;4.32,-.37,;5.65,-1.14,;7.14,-.74,;7.54,-2.23,;8.87,-3,;6.05,-2.62,)|
CC(=O)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(=O)C1CC1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(N)=N
Cn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2c(CCNC2=O)[nH]1
Cn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)NCCn2c1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(C)c2=O
C[C@@H](Oc1nc2c(cccc2nc1C)-c1cc2C(=O)N[C@H](C)c2[nH]1)C(F)(F)F
C[C@H]1NC(=O)c2c(Cl)c([nH]c12)-c1cccc2nc(C)c(NC3(C)CC3)nc12
C[C@H]1NC(=O)c2c(Cl)c([nH]c12)-c1cccc2nc(C)c(NC(C)(C)C)nc12
Cn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)NC3(CC3)c2[nH]1
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)CN1CCOCC1
COCCn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)NCc2[nH]1
COCCn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(OC1(C)CC1)n(C)c2=O
Cc1nc2cccc(-c3cc4C(=O)NC(CCO)c4[nH]3)c2nc1NC(C)(C)C
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CCC1)n(C)c2=O
Cc1nc2cccc(-c3cc4C(=O)NC(C)(C)c4[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc(n[nH]3)C(N)=O)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)N[C@@H](COCc5ccccc5)c4[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)NC(CO)c4[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)NC(CO)c4n3C)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)NCCn4n3)c2nc1NC(C)(C)C
C[C@@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C)c2=O
COCCN(CCOC)CCC(C)(C)Nc1nc2c(cccc2c(=O)n1C)-c1cc2C(=O)NCc2[nH]1
COCCOCCn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C1CC1)c2=O
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1C[C@H](C1)N(CCF)CCF |r,wU:24.30,22.25,(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;8.16,-.37,;8.55,-1.86,;7.07,-2.26,;9.89,-2.63,;11.22,-1.86,;12.56,-2.63,;13.89,-1.86,;9.89,-4.17,;11.22,-4.94,;11.22,-6.48,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1C[C@@H](C1)NCCF |r,wU:24.30,22.25,(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;7.07,-2.26,;8.55,-1.86,;8.16,-.37,;9.89,-2.63,;11.22,-1.86,;12.56,-2.63,;13.89,-1.86,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@@H]1C[C@@H](C1)NCC(F)F |r,wU:24.30,22.25,(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;7.07,-2.26,;8.55,-1.86,;8.16,-.37,;9.89,-2.63,;11.22,-1.86,;12.56,-2.63,;13.89,-1.86,;12.56,-4.17,)|
CN(C)[C@@H]1C[C@@H](C1)Nc1nc2c(cccc2nc1C)-c1cc2c(CCNC2=O)[nH]1 |r,wU:3.2,5.7,(11.22,-1.86,;9.89,-2.63,;9.89,-4.17,;8.55,-1.86,;8.16,-.37,;6.67,-.77,;7.07,-2.26,;5.33,,;4,-.77,;2.67,,;1.33,-.77,;;-1.33,-.77,;-1.33,-2.31,;,-3.08,;1.33,-2.31,;2.67,-3.08,;4,-2.31,;5.33,-3.08,;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,)|
Cc1nc2cccc(-c3cc4c(CCNC4=O)[nH]3)c2nc1N[C@H]1C[C@H](C1)N1CCOCC1 |r,wU:24.30,22.25,(5.33,-3.08,;4,-2.31,;2.67,-3.08,;1.33,-2.31,;,-3.08,;-1.33,-2.31,;-1.33,-.77,;;,1.54,;1.25,2.45,;.77,3.91,;-.77,3.91,;-1.54,5.24,;-.77,6.58,;.77,6.58,;1.54,5.24,;3.08,5.24,;-1.25,2.45,;1.33,-.77,;2.67,,;4,-.77,;5.33,,;6.67,-.77,;8.16,-.37,;8.55,-1.86,;7.07,-2.26,;9.89,-2.63,;11.22,-1.86,;12.56,-2.63,;12.56,-4.17,;11.22,-4.94,;9.89,-4.17,)|
CCn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(-c1cccnc1)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(N[C@H]3CCC[C@@H](N)C3)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c(N)nc(NC(C)(C)C)nc12
COCC1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(N[C@H]3CCC[C@H](C3)NC(C)=O)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(N[C@H]3CCC[C@H](C3)NCC(F)(F)F)nc12
CCN(C(C)C)c1nc2c(cccc2c(=O)[nH]1)-c1cc2C(=O)N[C@H](C)c2[nH]1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(N[C@H]3CCC[C@H](C3)NS(C)(=O)=O)nc12
CC(C)Nc1nc2c(-c3cc4C(=O)N[C@H](C)c4[nH]3)c(F)ccc2c(=O)n1C1CC1
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(N[C@H]3CCC[C@H](C3)NC(=O)[C@@H](CO)NC(=O)OC(C)(C)C)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(C1CC1)c2=O
COC[C@@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C)c2=O
COC[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2CN(C3CC3)C(NC3(C)CC3)=Nc12 |c:30|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CCC1)n(C1CC1)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2nc(C)c(N[C@H]3CCC[C@H](C3)NC(=O)[C@H](N)CO)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2c1nc(NC1(C)CCC1)n(C1CC1)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2cnc(NC3(C)CC3)nc12
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CCCO)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CC(F)(F)F)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2c1nc(NC1(C)CCC1)n(C)c2=O
Cn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](CCO)c2[nH]1
Cn1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](CCN)c2[nH]1
CC[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(N[C@H]1CCC[C@@H](N)C1)n(C)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C1CCC1)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CCCS(C)(=O)=O)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(N[C@@H]1CCC[C@@H](C1)NC(=O)OC(C)(C)C)n(C)c2=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1c(F)ccc2c1nc(NC1(C)CC1)n(C)c2=O
CC[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C1CC1)c2=O
CCn1c(NC(C)(C)C)nc2c(-c3cc4C(=O)N[C@H](C)c4[nH]3)c(F)ccc2c1=O
CCn1c(NC2(C)CC2)nc2c(-c3cc4C(=O)N[C@H](C)c4[nH]3)c(F)ccc2c1=O
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C1CCOCC1)c2=O
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CC(C)c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCc1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CC(C)c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CCc1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC(O)C1
CC(C)c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@@H](N)C1 |r|
CC(C)c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
C1CN(CCN1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncs1
N[C@@H]1CCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncs1 |r|
C1CC1c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
C1CC1c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
C[C@H]1CN(CCN1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(c1)C1COC1 |r|
C1OCC1c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
OC1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(c1)C1CC1
OC1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(c1)C1COC1
CCc1cncc(c1)-c1cc2n(ncc2cn1)-c1ccc(Cl)c(n1)N1CCC[C@H](N)C1 |r|
C1OCC1c1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1cc(sn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cc1cc(sn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCc1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNC[C@H](O)C1 |r|
CCc1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNC[C@@H](O)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cc1cc(sn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCN[C@@H](C)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC[C@H](O)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC[C@@H](O)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC(O)CC1
COc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNC(C)(C)C1
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC(N)CC1
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@@H](N)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC[C@H](N)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC[C@@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCc1cncc(c1)-c1cc2n(ncc2cn1)-c1ccc(C2CC2)c(n1)N1CCC[C@H](N)C1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCC(N)CC1
Cc1cncc(c1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CC[C@@H]1CN(CCN1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC)c1 |r|
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(NC2CCCCNC2)n1
C1CN(CCN1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnccn1
CC(C)(C)n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CC(C)n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
C1CC(C1)n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
Cn1ncc(cc1=O)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CCc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCn1cncc(-c2cc3n(ncc3cn2)-c2cccc(n2)N2CCNCC2)c1=O
OCCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
FCCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
FC(F)(F)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
N#CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
CS(=O)(=O)CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
C(C1COC1)n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
NC(=O)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1=CCNCC1 |t:26|
C(C1CC1)n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
FC(F)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
CCn1cc(cn1)-c1cc2n(ncc2cn1)-c1cncc(n1)N1CCCNCC1
Cc1cnc(O)c(c1)-c1cc2n(ncc2cn1)-c1cncc(n1)N1CCCNCC1
C1CC1c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1CCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC[C@@H](N)C1 |r|
CC1CN(CCN1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
CC(C)(C)c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CC1CCC(N)CN1c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
CCc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC(O)C1
FC(F)n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
C1CC1n1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
C1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncnc1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(Cl)c(n1)N1CCC[C@H](N)C1 |r|
N#Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
FC(F)(F)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cncc(n1)N1CCCNCC1
FC(F)(F)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1ccnc(n1)N1CCCNCC1
C1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cn[nH]c1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C2CC2)c(n1)N1CCC[C@H](N)C1 |r|
CC1CCN(CCN1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
COc1ccc(nc1N1CCC[C@H](N)C1)-n1ncc2cnc(cc12)-c1cncc(C)n1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCCC(N)C1
O[C@@H]1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
O[C@H]1CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(NC2CCNCC2)n1
C[C@@H]1CNCCN1c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1C[C@@H](N)C[C@H](F)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC(N)CC1
CC1C(N)CCCN1c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
C[C@H]1CNCCN1c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C2CC2)c(n1)N1CCCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1C[C@@H](N)C[C@@H](F)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC2(C1)CCNCC2
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC2(CCNC2)CC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C#N)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1C[C@@H](N)CCC1=O |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCCC1=O
COc1ccc(nc1N1CCNCC(O)C1)-n1ncc2cnc(cc12)-c1cncc(C)n1
Cc1nc(cnc1N)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1nc(cnc1N)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1CCCC(N)C1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC2(CNC2)C1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(F)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC2(CCCN2)CC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC2(C1)CCNC2
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(CO)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(c(n1)N1CCNCC(O)C1)C(F)(F)F
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(c(n1)N1CCC[C@H](N)C1)C(F)(F)F |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C)c(n1)N1C[C@@H](N)CCC1=O |r|
COc1ncc(nc1N1CCC[C@H](N)C1)-n1ncc2cnc(cc12)-c1cncc(C)n1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cnc(O)c(n1)N1CCC[C@H](N)C1 |r|
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](N)C1=O |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cnc(Cl)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C(F)F)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cnc(C)c(n1)N1CCC[C@H](N)C1 |r|
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC(O)C1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1(O)CCCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC(O)C(O)C1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cc(N2CCC[C@H](N)C2)c(=O)n(C)c1 |r|
COc1ccc(nc1N1CCNC[C@@H](O)C1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1CCCNCC1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1(F)CCCNCC1
COc1ccc(nc1N1CCNCC(O)C1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cnc(C2CC2)c(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCN(CC1)C1COC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cn(C)c(=O)c(n1)N1CCC[C@H](N)C1 |r|
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cn(C)c(=O)c(n1)N1CCC[C@H](N)C1 |r|
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cn(C)c(=O)c(n1)N1CCC[C@@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(C)c(n1)N1CCC[C@H](N)C1=O |r|
Nc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNCC1
C[C@]1(O)CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
C[C@@]1(O)CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cc(cc(n1)N1CCC[C@H](N)C1)C1COC1 |r|
COc1ccc(nc1N1CCCNC1=O)-n1ncc2cnc(cc12)-c1cncc(C)n1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCNC1=O
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC(O)C1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cn(C)c(=O)c(n1)N1CCNCC(O)C1
OC1CN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC(CN)C1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC(N)C1
NC1CN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1CNCCC1(F)F
Cc1ccc(nc1N1CCNC[C@@H](O)C1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
CO[C@@]1(C)CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
NCC1CN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1
Cc1ccc(nc1N1CCNC[C@H](O)C1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1 |r|
COC1(C)CNCCN(C1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1CNCCC1O
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC2(C1)CCCCN2
FC(F)(F)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC2(CNC2)C1
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC2(CNC2)C1
FC(F)(F)Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC2(C1)CCCCN2
Cn1cc(cn1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CC(O)(CN)C1
OCc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
C=Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Clc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
C(Oc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1)c1ccccc1
OCC(O)c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
OCCOc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
FC(F)c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
OC[C@@H]1CCCN1c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1 |r|
OC1CN(C1)c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
OCCNc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
O[C@H]1CCC[C@@H]1Nc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1 |r|
C1CN(C1)c1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
CCNc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
NCCOc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
O=c1cncc([nH]1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1(O)CCCNC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc(=O)n(n1)[C@H]1CCCNC1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCC2(CN(C2)C=O)C1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccc2OCC(CN)Cc2n1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCCC2(CNC2)C1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C1(F)CCCNC1
COC1(CCCNC1)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
CN(C)c1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
CNc1cccc(n1)-n1ncc2cnc(cc12)-c1cncc(C)n1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@@H](O)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC[C@H](O)C1 |r|
OCC#Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
OCCCc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C(=O)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)C(=O)N1CCC[C@@H](N)C1 |r|
N[C@H]1CCC[C@@H]1Oc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccccn1 |r|
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(OC2CCCC(N)C2)n1
FC1CCNCC1c1cccc(n1)-n1ncc2cnc(cc12)-c1cnn(CC(F)(F)F)c1
N[C@H]1CCC[C@@H]1Nc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccccn1 |r|
C1NCC1Nc1cncc(n1)-c1cc2n(ncc2cn1)-c1ccccn1
Cn1ncc(c1Cl)-c1cc2n(ncc2cn1)-c1ccccc1F
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCC(O)C(O)C1
Cc1cncc(n1)-c1cc2n(ncc2nn1)-c1cccc(n1)N1CCNCC1
Cn1ncc(c1C1=CCNCC1)-c1cc2n(ncc2cn1)-c1ccccc1F |t:7|
C#Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
Cn1ncc(c1N1CCC(N)CC1)-c1cc2n(ncc2cn1)-c1ccccc1F
CC#Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)N1CCNCC1
NC1CCCN(C1)c1ccncc1NC(=O)c1nc(cnc1N)-c1ccccc1C(F)(F)F
NC1CCN(CC1)c1ccncc1NC(=O)c1nc(cnc1N)-c1ccccc1F
NC1CCN(CC1)c1ccccc1NC(=O)c1nc(cnc1N)-c1ccccc1
NC1CCN(CC1)c1ccncc1NC(=O)c1nc(cnc1N)-c1ccccc1
COc1ccc(cc1)-c1cnc(N)c(n1)C(=O)Nc1cnccc1N1CCC(N)CC1
Nc1ncc(nc1C(=O)Nc1cnccc1N1CCNCC1)-c1ccccc1F
NC1CCN(CC1)c1cccnc1NC(=O)c1nc(cnc1N)-c1ncccc1C(F)(F)F
COc1ccc(cc1)-c1nnc2c3OCCN(C)c3c(NCC3CCN(C)CC3)nn12
CN1CCC(CC1)Nc1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CN1CCC(CC1)Nc1nn2c(nnc2c2N(C)CCOc12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1)-c1nnc2c3OCCN(C)c3c(NCCN3CCOCC3)nn12
CN(C)C1CCN(CC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CN(C)C1CCN(CC1)c1nn2c(nnc2c2N(C)CCOc12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c1c(NCC1CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(NCC3CC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c1c(NCc1ccc(F)cc1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(NCc3ccc(F)cc3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CCN1CCOc2c1c(NCC1CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CCN1CCOc2c(NCC3CCN(C)CC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CCN1CCOc2c(NC3CCOCC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1)-c1nnc2c3N(C)CCN(C)c3c(NCc3ccc(F)cc3)nn12
CN1CCC(CNc2nn3c(nnc3c3N(C)CCOc23)-c2cccc(OC(F)(F)F)c2)CC1
CN(CC1CCN(C)CC1)c1nn2c(nnc2c2N(C)CCOc12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(N[C@H]3CC[C@H](O)CC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1 |r,wU:11.11,wD:8.7,(.39,6.55,;-.94,5.78,;-2.27,6.55,;-3.61,5.78,;-3.61,4.24,;-2.27,3.47,;-2.27,1.93,;-3.61,1.16,;-3.61,-.38,;-4.94,-1.15,;-4.94,-2.69,;-3.61,-3.46,;-3.61,-5,;-2.27,-2.69,;-2.27,-1.15,;-.94,1.16,;.39,1.93,;1.86,1.45,;2.76,2.7,;1.86,3.94,;.39,3.47,;-.94,4.24,;2.63,.12,;4.17,.12,;4.94,-1.21,;4.17,-2.55,;2.63,-2.55,;1.86,-3.88,;2.63,-5.22,;3.4,-6.55,;4.17,-5.22,;1.86,-6.55,;1.86,-1.21,)|
CN1CCOc2c1c(NCCCO)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(NCCCO)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c1c(NC1CCOCC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
COc1ccc(CNc2nn3c(nnc3c3OCCN(C)c23)-c2cccc(OC(F)(F)F)c2)cc1OC
CN1CCOc2c1c(NCCc1cccnc1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCN(CCNc2nn3c(nnc3c3OCCN(C)c23)-c2cccc(OC(F)(F)F)c2)CC1
CN1CCN(CCNc2nn3c(nnc3c3N(C)CCOc23)-c2cccc(OC(F)(F)F)c2)CC1
CN1CCOc2c1c(NCCN1CCOCC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(NCCN3CCOCC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN1CCC(CNc2nn3c(nnc3c3OCCN(C)c23)-c2cccc(c2)C#N)CC1
CN1CCC(CNc2nn3c(nnc3c3OCCN(C)c23)-c2cccc(c2)C(F)(F)F)CC1
CN1CCC(CNc2nn3c(nnc3c3OCCN(C)c23)-c2ccc3[nH]ccc3c2)CC1
CN(C)c1cccc(c1)-c1nnc2c3OCCN(C)c3c(NCC3CCN(C)CC3)nn12
CN([C@H]1CC[C@H](O)CC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1 |r,wU:2.1,wD:5.5,(-6.57,1.15,;-5.24,.38,;-5.24,-1.16,;-3.91,-1.93,;-3.91,-3.47,;-5.24,-4.23,;-5.24,-5.77,;-6.57,-3.47,;-6.57,-1.93,;-3.91,1.15,;-2.57,.39,;-1.24,1.15,;.23,.68,;1.13,1.92,;.23,3.17,;-1.24,2.69,;-2.57,3.46,;-2.57,5,;-3.91,5.77,;-5.24,5,;-5.24,3.46,;-6.57,2.69,;-3.91,2.69,;.62,-.81,;-.46,-1.9,;-.07,-3.38,;1.42,-3.78,;2.51,-2.69,;4,-3.09,;5.09,-2,;6.57,-2.4,;4.69,-.52,;5.49,-3.49,;2.11,-1.21,)|
CC1COc2c(N1C)c(NCC1CCN(C)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CC1CN(C)c2c(NCC3CCN(C)CC3)nn3c(nnc3c2O1)-c1cccc(OC(F)(F)F)c1
CN1CCC(CNc2nn3c(nnc3c3OCCOc23)-c2cccc(OC(F)(F)F)c2)CC1
CN1CCOc2c(NCCN3CCNCC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CNC1CCN(CC1)c1nn2c(nnc2c2N(C)CCOc12)-c1cccc(OC(F)(F)F)c1
CN(C1CCNCC1)c1nn2c(nnc2c2N(C)CCOc12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1)N1CCC(N)CC1
CN1CCOc2c(NC3CCNCC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1)-c1nnc2c3OCCN(C)c3c(NCC3CCN(CC3)C(=O)OC(C)(C)C)nn12
COc1cccc(c1)-c1nnc2c3OCCN(C)c3c(NC3CCNCC3)nn12
CN1CCOc2c(NCC34CCN(CC3)C4)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c1c(NCC13CCN(CC1)C3)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1)N1CCC(CN)CC1
CN1CCOc2c(NCC3CCNCC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c1c(nn1c(nnc21)-c1cccc(OC(F)(F)F)c1)N1CCCC2(CCCN2)CC1
CN1CCCC11CCCN(CC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CNC1CCN(CC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CNCC1CCN(CC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1)N1CCC2(CC(N)C2)CC1
CN1CCOc2c1c(nn1c(nnc21)-c1cccc(OC(F)(F)F)c1)N1CCCC2(CCNCC2)C1
CN1CCOc2c1c(nn1c(nnc21)-c1cccc(OC(F)(F)F)c1)N1CC2(C1)CCCNC2
CN1CCC(CNc2nn3c(nnc3c3N(C)C(C)(C)COc23)-c2cccc(OC(F)(F)F)c2)CC1
CN1CCC(CNc2nn3c(nnc3c3OCC(C)(C)N(C)c23)-c2cccc(OC(F)(F)F)c2)CC1
CN1CCOc2c1c(NCC1CCN(CC1)C(=O)OC(C)(C)C)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1)-c1nnc2c3N(C)CCOc3c(NCc3ccc(F)cc3)nn12
COc1ccc(cc1)-c1nnc2c3OCCN(C)c3c(NCc3ccc(F)cc3)nn12
CN1CCOc2c(nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1)N1CC2(C1)CCNCC2
CN1CCC(CNc2nn3c(nnc3c3OCCN(C)c23)-c2ccc(O)cc2)CC1
CC(C)NCC1CCN(CC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CC(C)NCC1CCN(CC1)c1nn2c(nnc2c2N(C)CCOc12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c1c(NCC1CCN(CC3CC3)CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(NCC3CCN(CC4CC4)CC3)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
COc1ccc(cc1)-c1nnc2c3OCCN(C)c3c(nn12)N1CCC(CNC(C)=O)CC1
CN1CCN(C)c2c1c(NCc1ccc(F)cc1)nn1c(nnc21)-c1ccc(O)cc1
CN1CCOc2c(NCCN3CCN(CC3)C(C)=O)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN1CCOc2c(NCN(CCN3CCNCC3)S(C)(=O)=O)nn3c(nnc3c12)-c1cccc(OC(F)(F)F)c1
CN(C1CCOCC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CN(CCN1CCOCC1)c1nn2c(nnc2c2OCCN(C)c12)-c1cccc(OC(F)(F)F)c1
CN1CCC(CNc2nn3c(nnc3c3OCCN(C)c23)-c2ccc(F)cc2)CC1
FC(F)(F)Oc1cccc(c1)-c1nnc2c3OCCOc3c(nn12)N1CCCCC1
FC(F)(F)Oc1cccc(c1)-c1nnc2c3OCCOc3c(NCC3CC3)nn12
CN1CCOc2c1c(NC1CC[N+](C)([O-])CC1)nn1c(nnc21)-c1cccc(OC(F)(F)F)c1
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)-c1c(F)cccc1F |r|
CC(C)c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)C1CCOCC1 |r|
COc1cc(F)c(c(F)c1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
CCn1cc(cn1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
CC(C)c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
COc1ccc(cn1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)N1CCOCC1 |r|
CCc1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
CC(C)c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)C1CCOCC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCOCC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCOCC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC2(CCOCC2)CC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC2(CCOCC2)CC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(CC1)C#N |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(CC1)C#N |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCN(C)CC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCN(C)CC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(CC1)c1ccncc1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(CC1)c1ccncc1 |r|
CCN1CCN(CC1=O)c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
CCN1CCN(CC1=O)c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
COC1CCN(CC1)c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
COC1CCN(CC1)c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(CC1)N1CCOCC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(CC1)N1CCOCC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(C1)C(F)(F)F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(C1)C(F)(F)F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCCC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCCC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CC(C)(C)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CC(C)(C)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC1 |r|
COc1cc(F)c(c(F)c1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@@H](N)[C@H](O)[C@H](C1)C1CC1 |r|
COc1ccc(cn1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@@H](N)[C@H](O)[C@H](C1)C1CC1 |r|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)-c1ccc(nc1)N1CCOCC1 |r|
CCn1cc(cn1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@@H](N)[C@H](O)[C@H](C1)C1CC1 |r|
Cn1cc(cn1)-c1cnc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@@H](N)[C@H](O)[C@H](C1)C1CC1 |r|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)N1CCC2(CCOCC2)CC1 |r|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)N1CCC(CC1)C#N |r|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)N1CCC2(CCCO2)CC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)-c1cnn(C)c1 |r|
CCn1cc(cn1)-c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
COc1ccc(cn1)-c1ccc2ccc(nc2c1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)-c1ccc(nc1)N1CCOCC1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)-c1cccnc1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)-c1cnn(C)c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)-c1ccccc1C#N |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)N1CCC(O)CC1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1ccc2ncc(cc2n1)-c1ccccc1C#N)C(F)(F)F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2ccc(cc2n1)-c1ccc(OC2CCOCC2)nc1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOC1 |r,wU:5.5,1.0,wD:7.8,(-.67,.74,;-2,-.03,;-2,-1.57,;-3.33,-2.34,;-4.67,-1.57,;-4.67,-.03,;-6,.74,;-3.33,.74,;-3.33,2.28,;-3.33,-3.88,;-4.67,-4.65,;-4.67,-6.19,;-3.33,-6.96,;-2,-6.19,;-2,-4.65,;-.67,-3.88,;.67,-4.65,;2,-3.88,;3.33,-4.65,;4.67,-3.88,;4.67,-2.34,;6,-1.57,;3.33,-1.57,;2,-2.34,;3.33,-.03,;2,.74,;.67,-.03,;2,2.28,;3.33,3.05,;4.67,2.28,;4.67,.74,;6,-.03,;3.33,4.59,;4.67,3.82,;2.09,5.5,;2.56,6.96,;4.1,6.96,;4.58,5.5,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:5.5,1.0,wD:7.8,(-.67,.98,;-2,.21,;-2,-1.33,;-3.33,-2.1,;-4.67,-1.33,;-4.67,.21,;-6,.98,;-3.33,.98,;-3.33,2.52,;-3.33,-3.64,;-4.67,-4.41,;-4.67,-5.95,;-3.33,-6.72,;-2,-5.95,;-2,-4.41,;-.67,-3.64,;.67,-4.41,;2,-3.64,;3.33,-4.41,;4.67,-3.64,;4.67,-2.1,;6,-1.33,;3.33,-1.33,;2,-2.1,;3.33,.21,;2,.98,;.67,.21,;2,2.52,;3.33,3.29,;4.67,2.52,;4.67,.98,;6,.21,;3.33,4.83,;4.67,4.06,;3.73,6.32,;2.25,6.72,;1.85,5.23,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:5.5,1.0,wD:7.8,(-.67,.59,;-2,-.18,;-2,-1.72,;-3.33,-2.49,;-4.67,-1.72,;-4.67,-.18,;-6,.59,;-3.33,.59,;-3.33,2.13,;-3.33,-4.03,;-4.67,-4.8,;-4.67,-6.34,;-3.33,-7.11,;-2,-6.34,;-2,-4.8,;-.67,-4.03,;.67,-4.8,;2,-4.03,;3.33,-4.8,;4.67,-4.03,;4.67,-2.49,;6,-1.72,;3.33,-1.72,;2,-2.49,;3.33,-.18,;2,.59,;.67,-.18,;2,2.13,;3.33,2.9,;4.67,2.13,;4.67,.59,;6,-.18,;3.33,4.44,;4.67,3.67,;4.1,5.78,;3.33,7.11,;1.79,7.11,;1.02,5.78,;1.79,4.44,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOC1 |r,wU:3.3,1.0,(-.67,.74,;-2,-.03,;-3.33,.74,;-4.67,-.03,;-6,.74,;-4.67,-1.57,;-3.33,-2.34,;-2,-1.57,;-3.33,-3.88,;-4.67,-4.65,;-4.67,-6.19,;-3.33,-6.96,;-2,-6.19,;-2,-4.65,;-.67,-3.88,;.67,-4.65,;2,-3.88,;3.33,-4.65,;4.67,-3.88,;4.67,-2.34,;6,-1.57,;3.33,-1.57,;2,-2.34,;3.33,-.03,;2,.74,;.67,-.03,;2,2.28,;3.33,3.05,;4.67,2.28,;4.67,.74,;6,-.03,;3.33,4.59,;4.67,3.82,;2.09,5.5,;2.56,6.96,;4.1,6.96,;4.58,5.5,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:1.0,3.3,(-.67,.98,;-2,.21,;-3.33,.98,;-4.67,.21,;-6,.98,;-4.67,-1.33,;-3.33,-2.1,;-2,-1.33,;-3.33,-3.64,;-4.67,-4.41,;-4.67,-5.95,;-3.33,-6.72,;-2,-5.95,;-2,-4.41,;-.67,-3.64,;.67,-4.41,;2,-3.64,;3.33,-4.41,;4.67,-3.64,;4.67,-2.1,;6,-1.33,;3.33,-1.33,;2,-2.1,;3.33,.21,;2,.98,;.67,.21,;2,2.52,;3.33,3.29,;4.67,2.52,;4.67,.98,;6,.21,;3.33,4.83,;4.67,4.06,;3.73,6.32,;2.25,6.72,;1.85,5.23,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:1.0,3.3,(-.67,.59,;-2,-.18,;-3.33,.59,;-4.67,-.18,;-6,.59,;-4.67,-1.72,;-3.33,-2.49,;-2,-1.72,;-3.33,-4.03,;-4.67,-4.8,;-4.67,-6.34,;-3.33,-7.11,;-2,-6.34,;-2,-4.8,;-.67,-4.03,;.67,-4.8,;2,-4.03,;3.33,-4.8,;4.67,-4.03,;4.67,-2.49,;6,-1.72,;3.33,-1.72,;2,-2.49,;3.33,-.18,;2,.59,;.67,-.18,;2,2.13,;3.33,2.9,;4.67,2.13,;4.67,.59,;6,-.18,;3.33,4.44,;4.67,3.67,;4.1,5.78,;3.33,7.11,;1.79,7.11,;1.02,5.78,;1.79,4.44,)|
N[C@H]1C[C@H](CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1)C(F)(F)F |r,wU:1.0,3.39,(-6,.84,;-4.67,.07,;-3.33,.84,;-1.95,.09,;-2,-1.47,;-3.33,-2.24,;-4.67,-1.47,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;2,.84,;.67,.07,;2,2.38,;3.33,3.15,;4.67,2.38,;4.67,.84,;6,.07,;3.33,4.69,;4.67,3.92,;4.42,5.78,;3.33,6.86,;2.25,5.78,;-.62,.86,;.71,1.63,;.15,-.47,;-1.39,2.2,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CC1 |r,wU:1.0,5.5,wD:7.8,(-.67,1.15,;-2,.38,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-6,1.15,;-3.33,1.15,;-3.33,2.69,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;4.67,2.69,;4.67,1.15,;6,.38,;3.33,5,;4.67,4.23,;3.33,6.54,;2,5.78,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)ccc(c1F)C1(O)CC1 |r,wU:1.0,5.5,wD:7.8,(-1.33,2.03,;-2.67,1.26,;-2.67,-.28,;-4,-1.05,;-5.33,-.28,;-5.33,1.26,;-6.67,2.03,;-4,2.03,;-4,3.57,;-4,-2.59,;-5.33,-3.36,;-5.33,-4.9,;-4,-5.67,;-2.67,-4.9,;-2.67,-3.36,;-1.33,-2.59,;,-3.36,;1.33,-2.59,;2.67,-3.36,;4,-2.59,;4,-1.05,;5.33,-.28,;2.67,-.28,;1.33,-1.05,;2.67,1.26,;1.33,2.03,;,1.26,;1.33,3.57,;2.67,4.34,;4,3.57,;4,2.03,;5.33,1.26,;5.33,4.34,;6.67,3.57,;6.1,5.67,;4.56,5.67,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CC1 |r,wU:1.0,3.3,(-.67,1.15,;-2,.38,;-3.33,1.15,;-4.67,.38,;-6,1.15,;-4.67,-1.15,;-3.33,-1.93,;-2,-1.15,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.15,;.67,.38,;2,2.69,;3.33,3.47,;4.67,2.69,;4.67,1.15,;6,.38,;3.33,5,;4.67,4.23,;3.33,6.54,;2,5.78,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)ccc(c1F)C1(O)CC1 |r,wU:3.3,1.0,(-1.33,2.03,;-2.67,1.26,;-4,2.03,;-5.33,1.26,;-6.67,2.03,;-5.33,-.28,;-4,-1.05,;-2.67,-.28,;-4,-2.59,;-5.33,-3.36,;-5.33,-4.9,;-4,-5.67,;-2.67,-4.9,;-2.67,-3.36,;-1.33,-2.59,;,-3.36,;1.33,-2.59,;2.67,-3.36,;4,-2.59,;4,-1.05,;5.33,-.28,;2.67,-.28,;1.33,-1.05,;2.67,1.26,;1.33,2.03,;,1.26,;1.33,3.57,;2.67,4.34,;4,3.57,;4,2.03,;5.33,1.26,;5.33,4.34,;6.67,3.57,;6.1,5.67,;4.56,5.67,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CC(C)(C)O)cc1F |r,wU:5.5,1.0,wD:7.8,(-.67,.77,;-2,,;-2,-1.54,;-3.33,-2.31,;-4.67,-1.54,;-4.67,,;-6,.77,;-3.33,.77,;-3.33,2.31,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;3.33,4.62,;2,5.39,;.67,4.62,;2,6.93,;3.33,6.16,;4.67,2.31,;4.67,.77,;6,,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CC(C)(C)O)cc1F |r,wU:3.3,1.0,(-.67,.77,;-2,,;-3.33,.77,;-4.67,,;-6,.77,;-4.67,-1.54,;-3.33,-2.31,;-2,-1.54,;-3.33,-3.85,;-4.67,-4.62,;-4.67,-6.16,;-3.33,-6.93,;-2,-6.16,;-2,-4.62,;-.67,-3.85,;.67,-4.62,;2,-3.85,;3.33,-4.62,;4.67,-3.85,;4.67,-2.31,;6,-1.54,;3.33,-1.54,;2,-2.31,;3.33,,;2,.77,;.67,,;2,2.31,;3.33,3.08,;3.33,4.62,;2,5.39,;.67,4.62,;2,6.93,;3.33,6.16,;4.67,2.31,;4.67,.77,;6,,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.67,2.69,;-2,1.92,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.92,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.7,;-.67,-1.92,;.67,-2.69,;2,-1.92,;3.33,-2.69,;4.67,-1.92,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
COc1cccc(F)c1-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F |r,wU:26.28,22.24,wD:24.26,(6.72,2.67,;5.38,1.9,;4.05,2.67,;4,4.23,;2.67,5,;1.33,4.23,;1.33,2.69,;,1.93,;2.67,1.92,;2.67,.38,;1.33,-.38,;1.33,-1.92,;,-2.69,;-1.33,-1.92,;-2.67,-2.7,;-2.67,-4.23,;-4,-5,;-5.33,-4.23,;-5.33,-2.7,;-4,-1.93,;-4,-.39,;-2.67,.38,;-2.67,1.92,;-1.33,2.69,;-4,2.69,;-4,4.23,;-5.33,1.92,;-6.67,2.69,;-5.33,.38,;2.67,-2.69,;4,-1.92,;4,-.38,;5.33,.39,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cncc1F |r,wU:5.5,1.0,wD:7.8,(-.67,2.69,;-2,1.92,;-2,.38,;-3.33,-.39,;-4.67,.38,;-4.67,1.92,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.7,;-.67,-1.92,;.67,-2.69,;2,-1.92,;3.33,-2.69,;4.67,-1.92,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1C#N |r,wU:5.5,1.0,wD:7.8,(-1.33,2.69,;-2.67,1.92,;-2.67,.38,;-4,-.39,;-5.33,.38,;-5.33,1.92,;-6.67,2.69,;-4,2.69,;-4,4.23,;-4,-1.93,;-5.33,-2.7,;-5.33,-4.23,;-4,-5,;-2.67,-4.23,;-2.67,-2.7,;-1.33,-1.92,;,-2.69,;1.33,-1.92,;2.67,-2.69,;4,-1.92,;4,-.38,;5.33,.39,;2.67,.38,;1.33,-.38,;2.67,1.92,;1.33,2.69,;,1.93,;1.33,4.23,;2.67,5,;4,4.23,;4.05,2.67,;5.38,1.9,;6.72,1.13,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1ccccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.67,2.69,;-2,1.92,;-3.33,2.69,;-4.67,1.92,;-6,2.69,;-4.67,.38,;-3.33,-.39,;-2,.38,;-3.33,-1.93,;-4.67,-2.7,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.7,;-.67,-1.92,;.67,-2.69,;2,-1.92,;3.33,-2.69,;4.67,-1.92,;4.67,-.38,;6,.39,;3.33,.38,;2,-.38,;3.33,1.92,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
COc1cccc(F)c1-c1nc(CNc2cnccc2N2C[C@H](C)C[C@H](N)C2)ccc1F |r,wU:25.27,22.24,(6.72,2.67,;5.38,1.9,;4.05,2.67,;4,4.23,;2.67,5,;1.33,4.23,;1.33,2.69,;,1.92,;2.67,1.93,;2.67,.38,;1.33,-.38,;1.33,-1.93,;,-2.69,;-1.33,-1.93,;-2.67,-2.69,;-2.67,-4.23,;-4,-5,;-5.33,-4.23,;-5.33,-2.69,;-4,-1.93,;-4,-.38,;-2.67,.38,;-2.67,1.93,;-1.33,2.69,;-4,2.69,;-5.33,1.93,;-6.67,2.69,;-5.33,.38,;2.67,-2.69,;4,-1.93,;4,-.38,;5.33,.38,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cncc1F |r,wU:3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1C#N |r,wU:3.3,1.0,(-1.33,2.69,;-2.67,1.93,;-4,2.69,;-5.33,1.93,;-6.67,2.69,;-5.33,.38,;-4,-.38,;-2.67,.38,;-4,-1.93,;-5.33,-2.69,;-5.33,-4.23,;-4,-5,;-2.67,-4.23,;-2.67,-2.69,;-1.33,-1.93,;,-2.69,;1.33,-1.93,;2.67,-2.69,;4,-1.93,;4,-.38,;5.33,.38,;2.67,.38,;1.33,-.38,;2.67,1.93,;1.33,2.69,;,1.92,;1.33,4.23,;2.67,5,;4,4.23,;4.05,2.67,;5.38,1.9,;6.72,1.13,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)C#N |r,wU:7.8,wD:5.5,1.0,(.99,-.91,;2.32,-1.68,;2.32,-3.22,;3.66,-3.99,;4.99,-3.22,;4.99,-1.68,;6.33,-.91,;3.66,-.91,;3.66,.63,;3.66,-5.53,;4.99,-6.3,;4.99,-7.84,;3.66,-8.61,;2.32,-7.84,;2.32,-6.3,;.99,-5.53,;.99,-3.99,;-.34,-3.22,;-1.68,-3.99,;-3.01,-3.22,;-3.01,-1.68,;-4.34,-.91,;-1.68,-.91,;-.34,-1.68,;-1.68,.63,;-.34,1.4,;.99,.63,;-.34,2.94,;-1.68,3.71,;-3.01,2.94,;-3.01,1.4,;-4.34,.63,;-1.68,5.25,;-.14,5.25,;-3.22,5.25,;-1.68,6.79,;-1.68,8.33,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)C#N |r,wD:3.3,1.0,(1.19,-.94,;2.52,-1.71,;3.85,-.94,;5.19,-1.71,;6.52,-.94,;5.19,-3.25,;3.85,-4.02,;2.52,-3.25,;3.85,-5.56,;5.19,-6.33,;5.19,-7.87,;3.85,-8.64,;2.52,-7.87,;2.52,-6.33,;1.19,-5.56,;1.19,-4.02,;-.15,-3.25,;-1.48,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-4.15,-.94,;-1.48,-.94,;-.15,-1.71,;-1.48,.6,;-.15,1.37,;1.19,.6,;-.15,2.91,;-1.48,3.68,;-2.82,2.91,;-2.82,1.37,;-4.15,.6,;-1.48,5.22,;.06,5.22,;-3.02,5.22,;-1.48,6.76,;-1.48,8.3,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.67,2.69,;-2,1.93,;-2,.38,;-3.33,-.38,;-4.67,.38,;-4.67,1.93,;-6,2.69,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(c1)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.67,2.69,;-2,1.93,;-3.33,2.69,;-4.67,1.93,;-6,2.69,;-4.67,.38,;-3.33,-.38,;-2,.38,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(c1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:1.0,3.3,(-.66,.84,;-1.99,.07,;-3.33,.84,;-4.66,.07,;-5.99,.84,;-4.66,-1.47,;-3.34,-2.24,;-1.99,-1.47,;-3.34,-3.78,;-4.68,-4.55,;-4.68,-6.09,;-3.34,-6.86,;-2.01,-6.09,;-2.01,-4.55,;-.68,-3.78,;.66,-4.55,;1.99,-3.78,;3.33,-4.55,;4.66,-3.78,;4.66,-2.24,;5.99,-1.47,;3.33,-1.47,;1.99,-2.24,;3.33,.07,;1.99,.84,;.66,.07,;1.99,2.38,;3.33,3.15,;4.66,2.38,;4.66,.84,;5.99,.07,;3.33,4.69,;4.66,3.92,;4.41,5.78,;3.33,6.86,;2.24,5.78,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(c1)-c1c(F)cc(cc1F)C1(O)CCOCC1 |r,wU:1.0,3.3,(-.66,.59,;-1.99,-.18,;-3.33,.59,;-4.66,-.18,;-5.99,.59,;-4.66,-1.72,;-3.34,-2.49,;-1.99,-1.72,;-3.34,-4.03,;-4.68,-4.8,;-4.68,-6.34,;-3.34,-7.11,;-2.01,-6.34,;-2.01,-4.8,;-.68,-4.03,;.66,-4.8,;1.99,-4.03,;3.33,-4.8,;4.66,-4.03,;4.66,-2.49,;5.99,-1.72,;3.33,-1.72,;1.99,-2.49,;3.33,-.18,;1.99,.59,;.66,-.18,;1.99,2.13,;3.33,2.9,;4.66,2.13,;4.66,.59,;5.99,-.18,;3.33,4.44,;4.66,3.67,;4.1,5.78,;3.33,7.11,;1.79,7.11,;1.02,5.78,;1.79,4.44,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1cccc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1cccc(n1)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccnc(n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccnc(n1)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CCOCC1 |r,wU:5.5,1.0,wD:7.8,(-.67,.38,;-2,-.38,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-4.67,-.38,;-6,.38,;-3.33,.38,;-3.33,1.93,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.93,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,5.01,;4.67,6.55,;3.33,7.31,;2,6.55,;2,5.01,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CCOCC1 |r,wU:3.3,1.0,(-.67,.38,;-2,-.38,;-3.33,.38,;-4.67,-.38,;-6,.38,;-4.67,-1.93,;-3.33,-2.69,;-2,-1.93,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.93,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,5.01,;4.67,6.55,;3.33,7.31,;2,6.55,;2,5.01,)|
N[C@H]1C[C@H](CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CCOCC1)C(F)(F)F |r,wU:1.0,3.40,(-6,.38,;-4.67,-.38,;-3.33,.38,;-1.95,-.36,;-2,-1.93,;-3.33,-2.69,;-4.67,-1.93,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.93,;3.33,-1.93,;2,-2.69,;3.33,-.38,;2,.38,;.67,-.38,;2,1.93,;3.33,2.69,;4.67,1.93,;4.67,.38,;6,-.38,;3.33,4.23,;4.67,5.01,;4.67,6.55,;3.33,7.31,;2,6.55,;2,5.01,;-.62,.41,;.71,1.18,;.15,-.92,;-1.39,1.75,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CO)cc1F |r,wU:5.5,1.0,wD:7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CO)cc1F |r,wU:3.3,1.0,(-.67,1.54,;-2,.77,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,-1.54,;-2,-.77,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc2ncccc2c1F |r,wU:5.5,1.0,wD:7.8,(-.67,1.54,;-2,.77,;-2,-.77,;-3.33,-1.54,;-4.67,-.77,;-4.67,.77,;-6,1.54,;-3.33,1.54,;-3.33,3.08,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;6,5.39,;6,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc2ncccc2c1F |r,wU:3.3,1.0,(-.67,1.54,;-2,.77,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;-3.33,-1.54,;-2,-.77,;-3.33,-3.08,;-4.67,-3.85,;-4.67,-5.39,;-3.33,-6.16,;-2,-5.39,;-2,-3.85,;-.67,-3.08,;.67,-3.85,;2,-3.08,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,;3.33,-.77,;2,-1.54,;3.33,.77,;2,1.54,;.67,.77,;2,3.08,;3.33,3.85,;3.33,5.39,;4.67,6.16,;6,5.39,;6,3.85,;4.67,3.08,;4.67,1.54,;6,.77,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CN2CCOCC2)cc1F |r,wU:5.5,1.0,wD:7.8,(-.67,.39,;-2,-.38,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,.39,;-3.33,1.93,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.23,;.67,-5,;2,-4.23,;3.33,-5,;4.67,-4.23,;4.67,-2.69,;6,-1.92,;3.33,-1.92,;2,-2.69,;3.33,-.38,;2,.39,;.67,-.38,;2,1.93,;3.33,2.7,;3.33,4.23,;2,5,;2,6.54,;.67,7.31,;-.67,6.54,;-.67,5,;.67,4.23,;4.67,1.93,;4.67,.39,;6,-.38,)|
CNCc1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F |r,wU:28.30,24.26,wD:26.28,(.67,5.39,;2,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;.67,-3.85,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-3.33,3.08,;-4.67,.77,;-6,1.54,;-4.67,-.77,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CC2CCC2)cc1F |r,wU:5.5,1.0,wD:7.8,(-.67,.8,;-2,.03,;-2,-1.51,;-3.33,-2.28,;-4.67,-1.51,;-4.67,.03,;-6,.8,;-3.33,.8,;-3.33,2.34,;-3.33,-3.82,;-4.67,-4.59,;-4.67,-6.13,;-3.33,-6.9,;-2,-6.13,;-2,-4.59,;-.67,-3.82,;.67,-4.59,;2,-3.82,;3.33,-4.59,;4.67,-3.82,;4.67,-2.28,;6,-1.51,;3.33,-1.51,;2,-2.28,;3.33,.03,;2,.8,;.67,.03,;2,2.34,;3.33,3.11,;3.33,4.65,;2,5.42,;1.6,6.9,;.11,6.51,;.51,5.02,;4.67,2.34,;4.67,.8,;6,.03,)|
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C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(CN2CC[C@H](O)C2)cc1F |r,wU:5.5,1.0,wD:7.8,33.36,(-1.95,.53,;-3.29,-.24,;-3.29,-1.78,;-4.62,-2.55,;-5.96,-1.78,;-5.96,-.24,;-7.29,.53,;-4.62,.53,;-4.62,2.07,;-4.62,-4.09,;-5.96,-4.86,;-5.96,-6.4,;-4.62,-7.17,;-3.29,-6.4,;-3.29,-4.86,;-1.95,-4.09,;-.62,-4.86,;.71,-4.09,;2.05,-4.86,;3.38,-4.09,;3.38,-2.55,;4.71,-1.78,;2.05,-1.78,;.71,-2.55,;2.05,-.24,;.71,.53,;-.62,-.24,;.71,2.07,;2.05,2.84,;2.05,4.38,;3.38,5.15,;3.38,6.69,;4.84,7.17,;5.75,5.92,;7.29,5.92,;4.84,4.68,;3.38,2.07,;3.38,.53,;4.71,-.24,)|
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C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:5.5,1.0,wD:7.8,(-.67,.39,;-2,-.38,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,.39,;-3.33,1.93,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.24,;.67,-5.01,;2,-4.24,;3.33,-5.01,;4.67,-4.24,;4.67,-2.7,;6,-1.93,;3.33,-1.93,;2,-2.7,;3.33,-.39,;4.67,.38,;6,-.38,;4.67,1.92,;3.33,2.69,;2,1.92,;2,.38,;.67,-.39,;3.33,4.23,;4.67,3.46,;2,5,;2,6.54,;3.33,7.31,;4.67,6.54,;4.67,5,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(F)CCOCC1 |r,wU:3.3,1.0,(-.67,.39,;-2,-.38,;-3.33,.39,;-4.67,-.38,;-6,.39,;-4.67,-1.92,;-3.33,-2.69,;-2,-1.92,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.24,;.67,-5.01,;2,-4.24,;3.33,-5.01,;4.67,-4.24,;4.67,-2.7,;6,-1.93,;3.33,-1.93,;2,-2.7,;3.33,-.39,;4.67,.38,;6,-.38,;4.67,1.92,;3.33,2.69,;2,1.92,;2,.38,;.67,-.39,;3.33,4.23,;4.67,3.46,;2,5,;2,6.54,;3.33,7.31,;4.67,6.54,;4.67,5,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1CCOCC1 |r,wU:1.0,5.5,wD:7.8,(-.67,.39,;-2,-.38,;-2,-1.92,;-3.33,-2.69,;-4.67,-1.92,;-4.67,-.38,;-6,.39,;-3.33,.39,;-3.33,1.93,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.24,;.67,-5.01,;2,-4.24,;3.33,-5.01,;4.67,-4.24,;4.67,-2.7,;6,-1.93,;3.33,-1.93,;2,-2.7,;3.33,-.39,;4.67,.38,;6,-.39,;4.67,1.92,;3.33,2.69,;2,1.92,;2,.38,;.67,-.39,;3.33,4.23,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1CCOCC1 |r,wU:1.0,3.3,(-.67,.39,;-2,-.38,;-3.33,.39,;-4.67,-.38,;-6,.39,;-4.67,-1.92,;-3.33,-2.69,;-2,-1.92,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.24,;.67,-5.01,;2,-4.24,;3.33,-5.01,;4.67,-4.24,;4.67,-2.7,;6,-1.93,;3.33,-1.93,;2,-2.7,;3.33,-.39,;4.67,.38,;6,-.39,;4.67,1.92,;3.33,2.69,;2,1.92,;2,.38,;.67,-.39,;3.33,4.23,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,)|
N[C@H]1C[C@H](CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1CCOCC1)C(F)(F)F |r,wU:1.0,3.40,(-6,.66,;-4.67,-.11,;-3.33,.66,;-1.95,-.09,;-2,-1.65,;-3.33,-2.42,;-4.67,-1.65,;-3.33,-4.23,;-4.67,-5,;-4.67,-6.54,;-3.33,-7.31,;-2,-6.54,;-2,-5,;-.67,-4.24,;.67,-5.01,;2,-4.24,;3.33,-5.01,;4.67,-4.24,;4.67,-2.7,;6,-1.93,;3.33,-1.93,;2,-2.7,;3.33,-.39,;4.67,.38,;6,-.39,;4.67,1.92,;3.33,2.69,;2,1.92,;2,.38,;.67,-.39,;3.33,4.23,;4.67,5,;4.67,6.54,;3.33,7.31,;2,6.54,;2,5,;-.62,.68,;.71,1.45,;.15,-.65,;-1.39,2.02,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,1.0,3.3,(-.67,2.7,;-2,1.93,;-3.33,2.7,;-4.67,1.93,;-6,2.7,;-4.67,.39,;-3.33,-.38,;-2,.39,;-3.33,-1.92,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.7,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;4.67,2.69,;6,1.92,;4.67,4.23,;3.33,5,;2,4.23,;2,2.69,;.67,1.92,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C1(O)CCC1 |r,wU:6.8,3.3,1.0,(-.67,.84,;-2,.07,;-3.33,.84,;-4.67,.07,;-6,.84,;-4.67,-1.47,;-3.33,-2.24,;-2,-1.47,;-3.33,-3.78,;-4.67,-4.55,;-4.67,-6.09,;-3.33,-6.86,;-2,-6.09,;-2,-4.55,;-.67,-3.78,;.67,-4.55,;2,-3.78,;3.33,-4.55,;4.67,-3.78,;4.67,-2.24,;6,-1.47,;3.33,-1.47,;2,-2.24,;3.33,.07,;4.67,.84,;6,.07,;4.67,2.38,;3.33,3.15,;2,2.38,;2,.84,;.67,.07,;3.33,4.69,;4.67,3.92,;4.42,5.78,;3.33,6.86,;2.25,5.78,)|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CCOCC1 |r,wU:6.8,3.3,1.0,(-.67,.38,;-2,-.39,;-3.33,.38,;-4.67,-.39,;-6,.38,;-4.67,-1.93,;-3.33,-2.7,;-2,-1.93,;-3.33,-4.24,;-4.67,-5.01,;-4.67,-6.55,;-3.33,-7.31,;-2,-6.55,;-2,-5.01,;-.67,-4.24,;.67,-5.01,;2,-4.24,;3.33,-5.01,;4.67,-4.24,;4.67,-2.7,;6,-1.93,;3.33,-1.93,;2,-2.7,;3.33,-.39,;4.67,.38,;6,-.39,;4.67,1.92,;3.33,2.69,;2,1.92,;2,.38,;.67,-.39,;3.33,4.23,;4.67,5.01,;4.67,6.55,;3.33,7.31,;2,6.55,;2,5.01,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1nc(sc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CC[C@@H](F)C1 |r,wU:1.0,3.3,wD:34.38,(-.67,.07,;-2,-.7,;-3.33,.07,;-4.67,-.7,;-6,.07,;-4.67,-2.24,;-3.33,-3.01,;-2,-2.24,;-3.33,-4.55,;-4.67,-5.32,;-4.67,-6.86,;-3.33,-7.63,;-2,-6.86,;-2,-5.32,;-.67,-4.55,;.67,-5.32,;2,-4.55,;3.33,-5.32,;4.67,-4.55,;4.67,-3.01,;6,-2.24,;3.33,-2.24,;2,-3.01,;3.33,-.7,;4.67,.07,;6,-.7,;4.67,1.61,;3.33,2.38,;2,1.61,;2,.07,;.67,-.7,;3.33,3.92,;4.58,4.83,;4.1,6.29,;2.56,6.29,;1.79,7.63,;2.09,4.83,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CCCC(F)C1 |r,wU:1.0,3.3,(-.68,.38,;-2.01,-.39,;-3.34,.38,;-4.68,-.39,;-6.01,.38,;-4.68,-1.93,;-3.34,-2.7,;-2.01,-1.93,;-3.34,-4.24,;-4.68,-5.01,;-4.68,-6.54,;-3.34,-7.31,;-2.01,-6.54,;-2.01,-5.01,;-.68,-4.24,;.66,-5.01,;1.99,-4.24,;3.33,-5.01,;4.66,-4.24,;4.66,-2.7,;5.99,-1.93,;3.33,-1.93,;1.99,-2.7,;3.33,-.39,;4.66,.38,;5.99,-.39,;4.66,1.92,;3.33,2.69,;1.99,1.92,;1.99,.38,;.66,-.39,;3.33,4.23,;2.01,5,;2.01,6.54,;3.34,7.31,;4.68,6.54,;6.01,7.31,;4.68,5,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)N1CC(C)(O)C1 |r,wU:1.0,3.3,(-.67,.29,;-2,-.48,;-3.33,.29,;-4.67,-.48,;-6,.29,;-4.67,-2.02,;-3.33,-2.79,;-2,-2.02,;-3.33,-4.33,;-4.67,-5.1,;-4.67,-6.64,;-3.33,-7.41,;-2,-6.64,;-2,-5.1,;-.67,-4.33,;.67,-5.1,;2,-4.33,;3.33,-5.1,;4.67,-4.33,;4.67,-2.79,;6,-2.02,;3.33,-2.02,;2,-2.79,;3.33,-.48,;4.67,.29,;6,-.48,;4.67,1.83,;3.33,2.6,;2,1.83,;2,.29,;.67,-.48,;3.33,4.14,;4.42,5.23,;3.33,6.32,;2.25,7.41,;4.42,7.41,;2.25,5.23,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(O[C@@H]2CCOC2)cc1F |r,wU:1.0,5.5,30.32,wD:7.8,(-1.18,.53,;-2.52,-.24,;-2.52,-1.78,;-3.85,-2.55,;-5.19,-1.78,;-5.19,-.24,;-6.52,.53,;-3.85,.53,;-3.85,2.07,;-3.85,-4.09,;-5.19,-4.86,;-5.19,-6.4,;-3.85,-7.17,;-2.52,-6.4,;-2.52,-4.86,;-1.18,-4.09,;.15,-4.86,;1.48,-4.09,;2.82,-4.86,;4.15,-4.09,;4.15,-2.55,;5.48,-1.78,;2.82,-1.78,;1.48,-2.55,;2.82,-.24,;4.15,.53,;5.48,-.24,;4.15,2.07,;2.82,2.84,;2.82,4.38,;4.15,5.15,;5.61,4.68,;6.52,5.92,;5.61,7.17,;4.15,6.69,;1.48,2.07,;1.48,.53,;.15,-.24,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(O[C@@H]2CCOC2)cc1F |r,wU:3.3,1.0,29.31,(-1.18,.53,;-2.52,-.24,;-3.85,.53,;-5.19,-.24,;-6.52,.53,;-5.19,-1.78,;-3.85,-2.55,;-2.52,-1.78,;-3.85,-4.09,;-5.19,-4.86,;-5.19,-6.4,;-3.85,-7.17,;-2.52,-6.4,;-2.52,-4.86,;-1.18,-4.09,;.15,-4.86,;1.48,-4.09,;2.82,-4.86,;4.15,-4.09,;4.15,-2.55,;5.48,-1.78,;2.82,-1.78,;1.48,-2.55,;2.82,-.24,;1.48,.53,;.15,-.24,;1.48,2.07,;2.82,2.84,;2.82,4.38,;4.15,5.15,;5.61,4.68,;6.52,5.92,;5.61,7.17,;4.15,6.69,;4.15,2.07,;4.15,.53,;5.48,-.24,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(O[C@H]2CCOC2)cc1F |r,wU:5.5,1.0,wD:30.32,7.8,(-1.18,.53,;-2.52,-.24,;-2.52,-1.78,;-3.85,-2.55,;-5.19,-1.78,;-5.19,-.24,;-6.52,.53,;-3.85,.53,;-3.85,2.07,;-3.85,-4.09,;-5.19,-4.86,;-5.19,-6.4,;-3.85,-7.17,;-2.52,-6.4,;-2.52,-4.86,;-1.18,-4.09,;.15,-4.86,;1.48,-4.09,;2.82,-4.86,;4.15,-4.09,;4.15,-2.55,;5.48,-1.78,;2.82,-1.78,;1.48,-2.55,;2.82,-.24,;1.48,.53,;.15,-.24,;1.48,2.07,;2.82,2.84,;2.82,4.38,;4.15,5.15,;5.61,4.68,;6.52,5.92,;5.61,7.17,;4.15,6.69,;4.15,2.07,;4.15,.53,;5.48,-.24,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(O[C@H]2CCOC2)cc1F |r,wU:3.3,1.0,wD:29.31,(-1.18,.53,;-2.52,-.24,;-3.85,.53,;-5.19,-.24,;-6.52,.53,;-5.19,-1.78,;-3.85,-2.55,;-2.52,-1.78,;-3.85,-4.09,;-5.19,-4.86,;-5.19,-6.4,;-3.85,-7.17,;-2.52,-6.4,;-2.52,-4.86,;-1.18,-4.09,;.15,-4.86,;1.48,-4.09,;2.82,-4.86,;4.15,-4.09,;4.15,-2.55,;5.48,-1.78,;2.82,-1.78,;1.48,-2.55,;2.82,-.24,;1.48,.53,;.15,-.24,;1.48,2.07,;2.82,2.84,;2.82,4.38,;4.15,5.15,;5.61,4.68,;6.52,5.92,;5.61,7.17,;4.15,6.69,;4.15,2.07,;4.15,.53,;5.48,-.24,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:5.5,1.0,wD:7.8,(-1.33,.38,;-2.67,-.38,;-2.67,-1.93,;-4,-2.69,;-5.33,-1.93,;-5.33,-.38,;-6.67,.38,;-4,.38,;-4,1.93,;-4,-4.23,;-5.33,-5,;-5.33,-6.54,;-4,-7.31,;-2.67,-6.54,;-2.67,-5,;-1.33,-4.23,;,-5,;1.33,-4.23,;2.67,-5,;4,-4.23,;4,-2.69,;5.33,-1.93,;2.67,-1.93,;1.33,-2.69,;2.67,-.38,;1.33,.38,;,-.38,;1.33,1.93,;2.67,2.69,;2.67,4.23,;4,5,;5.33,4.23,;6.67,5,;6.67,6.54,;5.33,7.31,;4,6.54,;4,1.93,;4,.38,;5.33,-.38,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(OC2CCOCC2)cc1F |r,wU:3.3,1.0,(-1.33,.38,;-2.67,-.38,;-4,.38,;-5.33,-.38,;-6.67,.38,;-5.33,-1.93,;-4,-2.69,;-2.67,-1.93,;-4,-4.23,;-5.33,-5,;-5.33,-6.54,;-4,-7.31,;-2.67,-6.54,;-2.67,-5,;-1.33,-4.23,;,-5,;1.33,-4.23,;2.67,-5,;4,-4.23,;4,-2.69,;5.33,-1.93,;2.67,-1.93,;1.33,-2.69,;2.67,-.38,;1.33,.38,;,-.38,;1.33,1.93,;2.67,2.69,;2.67,4.23,;4,5,;5.33,4.23,;6.67,5,;6.67,6.54,;5.33,7.31,;4,6.54,;4,1.93,;4,.38,;5.33,-.38,)|
COc1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)ccc1F |r,wU:27.29,23.25,wD:25.27,(4.67,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;.67,-3.85,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-3.33,3.08,;-4.67,.77,;-6,1.54,;-4.67,-.77,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,)|
COc1cc(F)c(c(F)c1)-c1nc(CNc2cnccc2N2C[C@H](C)C[C@H](N)C2)ccc1F |r,wU:23.25,26.28,(4.67,6.16,;3.33,5.39,;3.33,3.85,;2,3.08,;2,1.54,;.67,.77,;3.33,.77,;4.67,1.54,;6,.77,;4.67,3.08,;3.33,-.77,;2,-1.54,;2,-3.08,;.67,-3.85,;-.67,-3.08,;-2,-3.85,;-2,-5.39,;-3.33,-6.16,;-4.67,-5.39,;-4.67,-3.85,;-3.33,-3.08,;-3.33,-1.54,;-2,-.77,;-2,.77,;-.67,1.54,;-3.33,1.54,;-4.67,.77,;-6,1.54,;-4.67,-.77,;3.33,-3.85,;4.67,-3.08,;4.67,-1.54,;6,-.77,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc(cc1F)C#N |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc2sccc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1ccc2CC(=O)Nc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,3.3,wD:12.13,(-.15,3.21,;-1.48,2.44,;-2.82,3.21,;-4.15,2.44,;-5.48,3.21,;-4.15,.9,;-2.82,.13,;-1.48,.9,;-2.82,-1.41,;-4.15,-2.18,;-5.61,-1.7,;-6.52,-2.95,;-5.61,-4.19,;-6.38,-5.52,;-4.15,-3.72,;-2.82,-4.49,;-1.48,-3.72,;-1.48,-2.18,;-.15,-1.41,;1.18,-2.18,;2.52,-1.41,;3.85,-2.18,;5.19,-1.41,;5.19,.13,;6.52,.9,;3.85,.9,;2.52,.13,;3.85,2.44,;2.52,3.21,;1.18,2.44,;2.52,4.75,;3.85,5.52,;5.19,4.75,;5.19,3.21,;6.52,2.44,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCOc2ncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,wD:7.8,(-.15,2.69,;-1.48,1.93,;-1.48,.38,;-2.82,-.38,;-4.15,.38,;-4.15,1.93,;-5.48,2.69,;-2.82,2.69,;-2.82,4.23,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;2.52,-1.93,;3.85,-2.69,;5.19,-1.93,;5.19,-.38,;6.52,.38,;3.85,.38,;2.52,-.38,;3.85,1.93,;2.52,2.69,;1.18,1.93,;2.52,4.23,;3.85,5,;5.19,4.23,;5.19,2.69,;6.52,1.93,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CCCc2ncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,3.3,(-.15,2.69,;-1.48,1.93,;-2.82,2.69,;-4.15,1.93,;-5.48,2.69,;-4.15,.38,;-2.82,-.38,;-1.48,.38,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;2.52,-1.93,;3.85,-2.69,;5.19,-1.93,;5.19,-.38,;6.52,.38,;3.85,.38,;2.52,-.38,;3.85,1.93,;2.52,2.69,;1.18,1.93,;2.52,4.23,;3.85,5,;5.19,4.23,;5.19,2.69,;6.52,1.93,)|
N[C@@H]1CN(CC[C@H]1F)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,wD:6.7,(-6,2.69,;-4.67,1.93,;-4.67,.38,;-3.33,-.38,;-2,.38,;-2,1.93,;-3.33,2.69,;-3.33,4.23,;-3.33,-1.93,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.69,;2,-1.93,;3.33,-2.69,;4.67,-1.93,;4.67,-.38,;6,.38,;3.33,.38,;2,-.38,;3.33,1.93,;2,2.69,;.67,1.93,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc2ccc(cc2n1)-c1ccc2CCOc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc2ccc(cc2n1)-c1ccn2ccnc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc2ccc(cc2n1)-c1ccn2ccnc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc2occ(-c3c(F)cc(CO)cc3F)c2n1 |r,wU:5.5,1.0,wD:7.8,(-.57,1.33,;-1.91,.56,;-1.91,-.98,;-3.24,-1.75,;-4.57,-.98,;-4.57,.56,;-5.91,1.33,;-3.24,1.33,;-3.24,2.87,;-3.24,-3.29,;-4.57,-4.06,;-4.57,-5.6,;-3.24,-6.37,;-1.91,-5.6,;-1.91,-4.06,;-.57,-3.29,;.76,-4.06,;2.1,-3.29,;3.43,-4.06,;4.76,-3.29,;4.76,-1.75,;5.91,-.72,;5.28,.69,;3.75,.53,;2.66,1.62,;1.17,1.22,;.77,-.27,;.08,2.31,;.48,3.79,;-.61,4.88,;-.21,6.37,;1.97,4.19,;3.06,3.1,;4.55,3.5,;3.43,-.98,;2.1,-1.75,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc2occ(-c3ccc(CO)cc3F)c2n1 |r|
CC(C)c1coc2ccc(CNc3cnccc3N3C[C@H](C)C[C@H](N)C3)nc12 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc2occ(-c3c(F)cc(CO)cc3F)c2n1 |r,wU:3.3,1.0,(-.57,1.33,;-1.91,.56,;-3.24,1.33,;-4.57,.56,;-5.91,1.33,;-4.57,-.98,;-3.24,-1.75,;-1.91,-.98,;-3.24,-3.29,;-4.57,-4.06,;-4.57,-5.6,;-3.24,-6.37,;-1.91,-5.6,;-1.91,-4.06,;-.57,-3.29,;.76,-4.06,;2.1,-3.29,;3.43,-4.06,;4.76,-3.29,;4.76,-1.75,;5.91,-.72,;5.28,.69,;3.75,.53,;2.66,1.62,;1.17,1.22,;.77,-.27,;.08,2.31,;.48,3.79,;-.61,4.88,;-.21,6.37,;1.97,4.19,;3.06,3.1,;4.55,3.5,;3.43,-.98,;2.1,-1.75,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc2occ(-c3ccc(CO)cc3F)c2n1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc2occ(C3CC3)c2n1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(OCC(C)(C)O)cc1F |r,wU:3.3,1.0,(-.67,,;-2,-.77,;-3.33,,;-4.67,-.77,;-6,,;-4.67,-2.31,;-3.33,-3.08,;-2,-2.31,;-3.33,-4.62,;-4.67,-5.39,;-4.67,-6.93,;-3.33,-7.7,;-2,-6.93,;-2,-5.39,;-.67,-4.62,;.67,-5.39,;2,-4.62,;3.33,-5.39,;4.67,-4.62,;4.67,-3.08,;6,-2.31,;3.33,-2.31,;2,-3.08,;3.33,-.77,;2,,;.67,-.77,;2,1.54,;3.33,2.31,;3.33,3.85,;2,4.62,;2,6.16,;.67,6.93,;2,7.7,;3.33,6.93,;4.67,1.54,;4.67,,;6,-.77,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(OCC(C)(C)O)cc1F |r,wU:5.5,1.0,wD:7.8,(-.67,,;-2,-.77,;-2,-2.31,;-3.33,-3.08,;-4.67,-2.31,;-4.67,-.77,;-6,,;-3.33,,;-3.33,1.54,;-3.33,-4.62,;-4.67,-5.39,;-4.67,-6.93,;-3.33,-7.7,;-2,-6.93,;-2,-5.39,;-.67,-4.62,;.67,-5.39,;2,-4.62,;3.33,-5.39,;4.67,-4.62,;4.67,-3.08,;6,-2.31,;3.33,-2.31,;2,-3.08,;3.33,-.77,;2,,;.67,-.77,;2,1.54,;3.33,2.31,;3.33,3.85,;2,4.62,;2,6.16,;.67,6.93,;2,7.7,;3.33,6.93,;4.67,1.54,;4.67,,;6,-.77,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)O |r,wU:3.3,1.0,(-.67,1.16,;-2,.38,;-3.33,1.15,;-4.67,.38,;-6,1.15,;-4.67,-1.15,;-3.33,-1.93,;-2,-1.15,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.16,;.67,.39,;2,2.7,;3.33,3.47,;4.67,2.7,;4.67,1.16,;6,.39,;3.33,5,;2,5.78,;4.67,5.78,;3.33,6.54,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)O |r,wU:5.5,1.0,wD:7.8,(-.67,1.16,;-2,.38,;-2,-1.15,;-3.33,-1.93,;-4.67,-1.15,;-4.67,.38,;-6,1.15,;-3.33,1.15,;-3.33,2.69,;-3.33,-3.47,;-4.67,-4.23,;-4.67,-5.78,;-3.33,-6.54,;-2,-5.78,;-2,-4.23,;-.67,-3.47,;.67,-4.23,;2,-3.47,;3.33,-4.23,;4.67,-3.47,;4.67,-1.93,;6,-1.15,;3.33,-1.15,;2,-1.93,;3.33,.38,;2,1.16,;.67,.39,;2,2.7,;3.33,3.47,;4.67,2.7,;4.67,1.16,;6,.39,;3.33,5,;2,5.78,;4.67,5.78,;3.33,6.54,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NCc1ccc2ccc(cc2n1)-c1ccn(C)c(=O)c1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NCc1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.3,1.0,(,1.54,;-1.33,.77,;-2.67,1.54,;-4,.77,;-5.33,1.54,;-4,-.77,;-2.67,-1.54,;-1.33,-.77,;-2.67,-3.08,;-4,-3.85,;-4,-5.39,;-2.67,-6.16,;-1.33,-5.39,;-1.33,-3.85,;,-3.08,;,-1.54,;1.33,-.77,;1.33,.77,;2.67,1.54,;4,.77,;5.33,1.54,;4,-.77,;2.67,-1.54,;2.67,-3.08,;2.67,3.08,;1.33,3.85,;,3.08,;1.33,5.39,;2.67,6.16,;4,5.39,;4,3.85,;5.33,3.08,)|
N[C@H]1C[C@H](CN(C1)c1ccncc1NCc1nc(c(F)cc1N)-c1c(F)cccc1F)C(F)(F)F |r,wU:1.0,3.34,(-6,2.7,;-4.67,1.93,;-3.33,2.7,;-2,1.93,;-2,.39,;-3.33,-.38,;-4.67,.39,;-3.33,-1.92,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-2,-2.69,;-.67,-1.93,;.67,-2.7,;2,-1.93,;2,-.39,;3.33,.38,;4.67,-.39,;6,.38,;4.67,-1.93,;3.33,-2.7,;3.33,-4.23,;3.33,1.92,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,;-.67,2.7,;.67,3.47,;-1.07,4.18,;-.27,4.18,)|
C[C@@H]1C[C@H](N)CN(C1)c1ccnc(F)c1NCc1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.67,2.7,;-2,1.93,;-3.33,2.7,;-4.67,1.93,;-6,2.7,;-4.67,.39,;-3.33,-.38,;-2,.39,;-3.33,-1.92,;-4.67,-2.69,;-4.67,-4.23,;-3.33,-5,;-2,-4.23,;-.67,-5,;-2,-2.69,;-.67,-1.93,;.67,-2.7,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
CC(Nc1cnccc1N1C[C@H](C)C[C@H](N)C1)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:14.15,11.12,(.67,-4.24,;.67,-2.7,;-.67,-1.93,;-2,-2.69,;-2,-4.23,;-3.33,-5,;-4.67,-4.23,;-4.67,-2.69,;-3.33,-1.92,;-3.33,-.38,;-2,.39,;-2,1.93,;-.67,2.7,;-3.33,2.7,;-4.67,1.93,;-6,2.7,;-4.67,.39,;2,-1.93,;3.33,-2.7,;4.67,-1.93,;4.67,-.39,;6,.38,;3.33,.38,;2,-.39,;3.33,1.92,;2,2.69,;.67,1.92,;2,4.23,;3.33,5,;4.67,4.23,;4.67,2.69,;6,1.93,)|
CCCc1cc2nc(ccc2o1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
CC(C)c1cc2nc(ccc2o1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
COc1ccc(cn1)-c1cc2nc(ccc2o1)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2oc(cc2n1)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2oc(cc2n1)-c1ccc(nc1)N1CCOCC1 |r|
CC(C)c1cc2nc(ccc2o1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
COc1ccc(cn1)-c1cc2nc(ccc2o1)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2oc(cc2n1)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2oc(cc2n1)-c1ccc(nc1)N1CCOCC1 |r|
CC(C)c1coc2ccc(nc12)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2occ(-c3c(F)cccc3F)c2n1 |r,wU:5.5,1.0,wD:7.8,(-.57,2.42,;-1.91,1.65,;-1.91,.11,;-3.24,-.66,;-4.57,.11,;-4.57,1.65,;-5.91,2.42,;-3.24,2.42,;-3.24,3.96,;-3.24,-2.2,;-4.57,-2.97,;-4.57,-4.51,;-3.24,-5.28,;-1.91,-4.51,;-1.91,-2.97,;-.57,-2.2,;.76,-2.97,;.76,-4.51,;2.1,-2.2,;3.43,-2.97,;4.76,-2.2,;4.76,-.66,;5.91,.37,;5.28,1.78,;3.75,1.62,;2.66,2.7,;1.17,2.31,;.77,.82,;.08,3.39,;.48,4.88,;1.97,5.28,;3.06,4.19,;4.55,4.59,;3.43,.11,;2.1,-.66,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2occ(-c3ccccc3F)c2n1 |r|
COc1ccc(F)c(-c2coc3ccc(nc23)C(=O)Nc2cnccc2N2C[C@H](C)[C@@H](O)[C@H](N)C2)c1F |r,wU:32.35,28.31,wD:30.33,(1.29,6.62,;2.38,5.53,;1.98,4.05,;.48,3.59,;.08,2.11,;1.17,1.02,;.77,-.47,;2.66,1.42,;3.75,.33,;5.28,.49,;5.91,-.92,;4.76,-1.95,;4.76,-3.49,;3.43,-4.26,;2.1,-3.49,;2.1,-1.95,;3.43,-1.18,;.76,-4.26,;.76,-5.8,;-.57,-3.49,;-1.91,-4.26,;-1.91,-5.8,;-3.24,-6.57,;-4.57,-5.8,;-4.57,-4.26,;-3.24,-3.49,;-3.24,-1.95,;-1.91,-1.18,;-1.91,.36,;-.57,1.13,;-3.24,1.13,;-3.24,2.67,;-4.57,.36,;-5.91,1.13,;-4.57,-1.18,;3.06,2.9,;4.55,3.3,)|
COc1ccc(cn1)-c1coc2ccc(nc12)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
CCc1coc2ccc(nc12)C(=O)Nc1cnccc1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2occ(C3CCN(C)CC3)c2n1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1ccc2occ(C3CCOCC3)c2n1 |r|
CC(C)c1coc2ccc(nc12)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2occ(-c3c(F)cccc3F)c2n1 |r,wU:3.3,1.0,(-.57,2.42,;-1.91,1.65,;-3.24,2.42,;-4.57,1.65,;-5.91,2.42,;-4.57,.11,;-3.24,-.66,;-1.91,.11,;-3.24,-2.2,;-4.57,-2.97,;-4.57,-4.51,;-3.24,-5.28,;-1.91,-4.51,;-1.91,-2.97,;-.57,-2.2,;.76,-2.97,;.76,-4.51,;2.1,-2.2,;3.43,-2.97,;4.76,-2.2,;4.76,-.66,;5.91,.37,;5.28,1.78,;3.75,1.62,;2.66,2.7,;1.17,2.31,;.77,.82,;.08,3.39,;.48,4.88,;1.97,5.28,;3.06,4.19,;4.55,4.59,;3.43,.11,;2.1,-.66,)|
CCc1coc2ccc(nc12)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc2occ(-c3ccccc3F)c2n1 |r|
COc1ccc(F)c(-c2coc3ccc(nc23)C(=O)Nc2cnccc2N2C[C@H](C)C[C@H](N)C2)c1F |r,wU:31.34,28.31,(1.29,6.62,;2.38,5.53,;1.98,4.05,;.48,3.59,;.08,2.11,;1.17,1.02,;.77,-.47,;2.66,1.42,;3.75,.33,;5.28,.49,;5.91,-.92,;4.76,-1.95,;4.76,-3.49,;3.43,-4.26,;2.1,-3.49,;2.1,-1.95,;3.43,-1.18,;.76,-4.26,;.76,-5.8,;-.57,-3.49,;-1.91,-4.26,;-1.91,-5.8,;-3.24,-6.57,;-4.57,-5.8,;-4.57,-4.26,;-3.24,-3.49,;-3.24,-1.95,;-1.91,-1.18,;-1.91,.36,;-.57,1.13,;-3.24,1.13,;-4.57,.36,;-5.91,1.13,;-4.57,-1.18,;3.06,2.9,;4.55,3.3,)|
COc1ccc(cn1)-c1coc2ccc(nc12)C(=O)Nc1cnccc1N1C[C@H](C)C[C@H](N)C1 |r|
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C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCCC1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCC(O)CC1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCC(CC1)C#N |r|
CC1CCN(CC1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COC[C@H]1CCCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COC[C@@H]1CCCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@@H]1CCN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@H]1CCN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COCCN(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@H](Nc1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1)C1CC1 |r|
CC(C)[C@H](C)Nc1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CC(C)[C@@H](C)Nc1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CCCN(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CC(C)N(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CCC1CCCCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCCC1C(F)F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1cc(F)cc2cccnc12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1ccc(F)c2cccnc12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1ccc(nc1)C(F)(F)F |r|
CCn1cc(cn1)-c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1cn(C)nc1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1cnn(C)c1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1c[nH]nc1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)-c1cn[nH]c1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc2cc(cnc12)N1CCOC[C@H]1C |r|
C[C@@H]1CCCN1c1cnc2c(cccc2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@H]1CCCN1c1cnc2c(cccc2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc2cc(cnc12)N1CCCCC1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc2cc(cnc12)N1CCCCC1C(F)F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1cccc2cc(cnc12)N(C)CC(F)F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCSCC1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(CC1)S(=O)(=O)N(C)C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C)C(=O)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCCCC1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C2CCC1COC2 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCC1=O |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCc2ccccc12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C[C@H]2C[C@@H]1CO2 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC2CC(C1)O2 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(CC1)C(=O)N(C)C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccccc1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN2C(CCC2=O)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C[C@@H]1C)S(C)(=O)=O |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C[C@H]1C)S(C)(=O)=O |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C[C@H]2C[C@@H]1CN2S(C)(=O)=O |r|
COC(=O)N1CCN([C@@H](C)C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COC(=O)N1CCN([C@H](C)C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COC(=O)N1C[C@H]2C[C@@H]1CN2c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(nnc12)-c1c(F)cccc1F |r|
CCc1cc2c(F)ccc(C(=O)Nc3cnccc3[C@@H]3C[C@H](C)C[C@H](N)C3)c2nn1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(nnc12)N1CCCCC1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(nnc12)N1CCOC[C@H]1C |r|
C[C@@H]1CCCN1c1cc2c(F)ccc(C(=O)Nc3cnccc3[C@@H]3C[C@H](C)C[C@H](N)C3)c2nn1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC2CCC1C2 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C2CCC1CC(O)C2 |r,TLB:24:28:30.31:33.36.34,THB:35:34:30.31:28|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC(=O)N(C)C[C@H]1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C[C@H]2CCCCN2C(=O)C1 |r|
COC1CCCN(CC1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCOCC1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC2(CC(O)C2)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCC(O)CC1 |r|
C[C@@H]1CCCN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C2CCCC1COC2 |r,THB:24:28:30.32.31:34.36.35|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC2(CCC2)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCCO1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC2COCC2C1 |r|
CC1CN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C)C(=O)[C@@H]1C |r|
C[C@H]1CCCN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCN(C2CC2)C(=O)C1 |r|
CC(C)N1CCN(CC1=O)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC(C)(C)C1 |r|
CC(C)CN1CCN(CC1=O)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COC1(C)CN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCc2nn(C)cc2C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCOc2cccc(F)c12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC2(C1)CCOCC2 |r|
CCOC1CN(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CC[C@H]1CO |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCN(C)CC1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(Nc3ccccc3F)cnc12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCc2cnn(C)c2C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCN(C)S1(=O)=O |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(Nc3ccccc3C#N)cnc12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCc2ccccc12 |r|
COC1CCN(CC1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCOC(CO)C1 |r|
COCCN1CCN(CC1=O)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCn2cnnc2C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCN(C)C(=O)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1C2CCC1CC2 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCc2cccc(F)c12 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCS1(=O)=O |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ncccc1OC(F)F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCCC1C#N |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccc(C)nc1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ncccc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1cnccc1C(F)(F)F |r|
COc1ccc(N(C)c2cnc3c(ccc(F)c3c2)C(=O)Nc2cnccc2[C@@H]2C[C@H](C)C[C@H](N)C2)c(C)n1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccncc1F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1cnccc1C |r|
CC1CCC1N(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COc1ccc(cc1)N(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1nccnc1C |r|
COc1ccncc1N(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)C1CCCOC1 |r|
COc1ccccc1N(C)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)c1ccc2nccn2c1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N(C)[C@@H]1CCOC1 |r|
CO[C@@H]1C[C@H](C)N(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@@H]1C[C@@H](C)N(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@H]1C[C@H](C)N(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@H]1C[C@@H](C)N(C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@H]1CCN([C@H](C)C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@@H]1CCN([C@@H](C)C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@@H]1CCN([C@H](C)C1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CO[C@@H]1CCN(C[C@H]1F)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
COCCO[C@H]1CCN(C[C@@H]1F)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](O)CN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@H]1C[C@H](O)CN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@H]1CCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1CCN1c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
CCOC(=O)N1CCN(CC1)c1cnc2c(ccc(F)c2c1)C(=O)Nc1cnccc1[C@@H]1C[C@H](C)C[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCC[C@H]1C |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1ccc(F)c2cc(cnc12)N1CCCC[C@@H]1C |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2ccccc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2csc(n2)-c2c(F)cccc2F)cnc2ccccc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2sccc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2csc(n2)-c2c(F)cccc2F)cnc2sccc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2ccsc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2csc(n2)-c2c(F)cccc2F)cnc2ccsc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2[nH]ccc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2csc(n2)-c2c(F)cccc2F)cnc2[nH]ccc12 |r|
N[C@H]1CCCN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CCOc2ncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CCOc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,(-5.48,2.69,;-4.15,1.93,;-2.82,2.69,;-1.48,1.93,;-1.48,.38,;-2.82,-.38,;-4.15,.38,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;1.18,-4.23,;2.52,-1.93,;3.85,-2.69,;5.19,-1.93,;5.19,-.38,;6.52,.38,;3.85,.38,;2.52,-.38,;3.85,1.93,;2.52,2.7,;1.18,1.93,;2.52,4.24,;3.85,5,;5.19,4.24,;5.19,2.7,;6.52,1.93,)|
N[C@H]1CCCN(C1)c1c2CCOc2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:1.0,(-5.48,2.69,;-4.15,1.93,;-2.82,2.69,;-1.48,1.93,;-1.48,.38,;-2.82,-.38,;-4.15,.38,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;1.18,-4.23,;2.52,-1.93,;2.52,-.38,;3.85,.38,;5.19,-.38,;6.52,.38,;5.19,-1.93,;3.85,-2.69,;3.85,-4.23,;3.85,1.93,;2.52,2.7,;1.18,1.93,;2.52,4.24,;3.85,5,;5.19,4.24,;5.19,2.7,;6.52,1.93,)|
N[C@H]1CCCN(C1)c1c2CCCc2ncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
COC1CCc2c1ncc(NC(=O)c1nc(sc1N)-c1c(F)cccc1F)c2N1CCC[C@H](N)C1 |r|
N[C@H]1CCCN(C1)c1c2CC[C@H](C#N)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CC[C@@H](C#N)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@]1(O)CCc2c1ncc(NC(=O)c1nc(sc1N)-c1c(F)cccc1F)c2N1CCC[C@H](N)C1 |r|
C[C@@]1(O)CCc2c1ncc(NC(=O)c1nc(sc1N)-c1c(F)cccc1F)c2N1CCC[C@H](N)C1 |r|
N[C@H]1CCCN(C1)c1c2CCC(=O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CCCc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,(-5.48,2.69,;-4.15,1.93,;-2.82,2.69,;-1.48,1.93,;-1.48,.39,;-2.82,-.38,;-4.15,.39,;-2.82,-1.92,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.46,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.92,;1.18,-2.69,;1.18,-4.23,;2.52,-1.92,;3.85,-2.7,;5.19,-1.92,;5.19,-.38,;6.52,.39,;3.85,.39,;2.52,-.38,;3.85,1.93,;2.52,2.69,;1.18,1.93,;2.52,4.23,;3.85,5,;5.19,4.23,;5.19,2.69,;6.52,1.93,)|
N[C@H]1CCCN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,11.12,(-5.48,3.29,;-4.15,2.52,;-2.82,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
N[C@H]1CCCN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,wD:11.12,(-5.48,3.29,;-4.15,2.52,;-2.82,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
N[C@H]1CCCN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:1.0,11.12,(-5.48,3.29,;-4.15,2.52,;-2.82,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
N[C@H]1CCCN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:1.0,wD:11.12,(-5.48,3.29,;-4.15,2.52,;-2.82,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
N[C@H]1CN(CC[C@@H]1O)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@H]1O)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CN(CC[C@H]1O)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@@H]1O)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@@H]1CN(CC[C@H]1O)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2ccsc12 |r|
N[C@@H]1CN(CC[C@@H]1O)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2ccsc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2NCCCc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(c(F)cc2N)-c2c(F)cccc2F)cnc2NCCCc12 |r,wU:1.0,(-5.33,2.7,;-4,1.93,;-2.67,2.7,;-1.33,1.93,;-1.33,.39,;-2.67,-.38,;-4,.39,;-2.67,-1.92,;-1.33,-2.69,;,-1.92,;1.33,-2.69,;1.33,-4.23,;2.67,-1.92,;2.67,-.38,;4,.39,;5.33,-.38,;6.67,.39,;5.33,-1.92,;4,-2.7,;4,-4.24,;4,1.93,;2.67,2.69,;1.33,1.93,;2.67,4.23,;4,5,;5.33,4.23,;5.33,2.69,;6.67,1.93,;-1.33,-4.23,;-2.67,-5,;-4,-4.23,;-5.33,-5,;-6.67,-4.23,;-6.67,-2.69,;-5.33,-1.92,;-4,-2.69,)|
N[C@H]1CCCN(C1)c1c(NC(=O)c2ccc(F)c(n2)-c2c(F)cccc2F)cnc2NCCCc12 |r,wU:1.0,(-5.33,2.69,;-4,1.93,;-2.67,2.69,;-1.33,1.93,;-1.33,.39,;-2.67,-.38,;-4,.39,;-2.67,-1.92,;-1.33,-2.69,;,-1.92,;1.33,-2.69,;1.33,-4.23,;2.67,-1.92,;4,-2.7,;5.33,-1.92,;5.33,-.38,;6.67,.39,;4,.39,;2.67,-.38,;4,1.93,;2.67,2.69,;1.33,1.93,;2.67,4.23,;4,5,;5.33,4.23,;5.33,2.69,;6.67,1.93,;-1.33,-4.23,;-2.67,-5,;-4,-4.23,;-5.33,-5,;-6.67,-4.23,;-6.67,-2.69,;-5.33,-1.92,;-4,-2.69,)|
N[C@H]1CCCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnc2[nH]ncc12 |r|
N[C@H]1CCCN(C1)c1c(NC(=O)c2csc(n2)-c2c(F)cccc2F)cnc2[nH]ncc12 |r|
C[C@@H]1C[C@H](N)CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:13.14,5.5,1.0,wD:7.8,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-2.82,4.83,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:13.14,7.8,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-2.82,4.83,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.15,2.69,;-1.48,1.93,;-2.82,2.69,;-4.15,1.93,;-5.48,2.69,;-4.15,.38,;-2.82,-.38,;-1.48,.38,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;1.18,-4.23,;2.52,-1.93,;2.52,-.38,;3.85,.38,;5.19,-.38,;6.52,.38,;5.19,-1.93,;3.85,-2.69,;3.85,-4.23,;3.85,1.93,;2.52,2.7,;1.18,1.93,;2.52,4.24,;3.85,5,;5.19,4.24,;5.19,2.7,;6.52,1.93,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CCOc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.15,2.69,;-1.48,1.93,;-2.82,2.69,;-4.15,1.93,;-5.48,2.69,;-4.15,.38,;-2.82,-.38,;-1.48,.38,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;1.18,-4.23,;2.52,-1.93,;3.85,-2.69,;5.19,-1.93,;5.19,-.38,;6.52,.38,;3.85,.38,;2.52,-.38,;3.85,1.93,;2.52,2.7,;1.18,1.93,;2.52,4.24,;3.85,5,;5.19,4.24,;5.19,2.7,;6.52,1.93,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCOc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.15,2.69,;-1.48,1.93,;-1.48,.39,;-2.82,-.38,;-4.15,.39,;-4.15,1.93,;-5.48,2.69,;-2.82,2.69,;-2.82,4.23,;-2.82,-1.92,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.46,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.92,;1.18,-2.69,;1.18,-4.23,;2.52,-1.92,;3.85,-2.69,;5.19,-1.92,;5.19,-.38,;6.52,.39,;3.85,.39,;2.52,-.38,;3.85,1.93,;2.52,2.69,;1.18,1.93,;2.52,4.23,;3.85,5,;5.19,4.23,;5.19,2.69,;6.52,1.93,)|
N[C@H]1C[C@H](CN(C1)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1c2CCOc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F)C(F)(F)F |r,wU:1.0,3.38,(-5.48,2.69,;-4.15,1.93,;-2.82,2.69,;-1.41,2.01,;-1.48,.39,;-2.82,-.38,;-4.15,.39,;-2.82,-1.92,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.46,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.92,;1.18,-2.69,;1.18,-4.23,;2.52,-1.92,;3.85,-2.69,;5.19,-1.92,;5.19,-.38,;6.52,.39,;3.85,.39,;2.52,-.38,;3.85,1.93,;2.52,2.69,;1.18,1.93,;2.52,4.23,;3.85,5,;5.19,4.23,;5.19,2.69,;6.52,1.93,;-.08,2.8,;1.24,3.58,;.7,1.47,;-.87,4.12,)|
N[C@H]1C[C@H](CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F)C(F)(F)F |r|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:12.13,3.3,1.0,(-.15,3.29,;-1.48,2.52,;-2.82,3.29,;-4.15,2.52,;-5.48,3.29,;-4.15,.98,;-2.82,.21,;-1.48,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.3,1.0,wD:12.13,(-.15,3.29,;-1.48,2.52,;-2.82,3.29,;-4.15,2.52,;-5.48,3.29,;-4.15,.98,;-2.82,.21,;-1.48,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:12.13,3.3,1.0,(-.15,3.29,;-1.48,2.52,;-2.82,3.29,;-4.15,2.52,;-5.48,3.29,;-4.15,.98,;-2.82,.21,;-1.48,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.3,1.0,wD:12.13,(-.15,3.29,;-1.48,2.52,;-2.82,3.29,;-4.15,2.52,;-5.48,3.29,;-4.15,.98,;-2.82,.21,;-1.48,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:13.14,5.5,1.0,wD:7.8,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-2.82,4.83,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:13.14,7.8,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-2.82,4.83,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CCC(=O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,(-5.48,3.29,;-4.15,2.52,;-2.82,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
CCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:25.27,37.41,33.37,wD:35.39,(5.19,7.53,;5.19,5.99,;3.85,5.22,;3.85,3.68,;2.52,2.91,;2.52,1.37,;1.18,.6,;3.85,.6,;5.19,1.37,;6.52,.6,;5.19,2.91,;3.85,-.94,;2.52,-1.71,;2.52,-3.25,;3.85,-4.02,;5.19,-3.25,;5.19,-1.71,;6.52,-.94,;1.18,-4.02,;1.18,-5.56,;-.15,-3.25,;-1.48,-4.02,;-1.48,-5.56,;-2.82,-6.33,;-4.15,-5.56,;-5.61,-6.04,;-6.01,-7.53,;-6.52,-4.79,;-5.61,-3.55,;-4.15,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-1.48,-.94,;-1.48,.6,;-.15,1.37,;-2.82,1.37,;-2.82,2.91,;-4.15,.6,;-5.48,1.37,;-4.15,-.94,)|
CCOc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:37.41,33.37,wD:25.27,35.39,(5.19,7.53,;5.19,5.99,;3.85,5.22,;3.85,3.68,;2.52,2.91,;2.52,1.37,;1.18,.6,;3.85,.6,;5.19,1.37,;6.52,.6,;5.19,2.91,;3.85,-.94,;2.52,-1.71,;2.52,-3.25,;3.85,-4.02,;5.19,-3.25,;5.19,-1.71,;6.52,-.94,;1.18,-4.02,;1.18,-5.56,;-.15,-3.25,;-1.48,-4.02,;-1.48,-5.56,;-2.82,-6.33,;-4.15,-5.56,;-5.61,-6.04,;-6.01,-7.53,;-6.52,-4.79,;-5.61,-3.55,;-4.15,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-1.48,-.94,;-1.48,.6,;-.15,1.37,;-2.82,1.37,;-2.82,2.91,;-4.15,.6,;-5.48,1.37,;-4.15,-.94,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCCc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.15,2.69,;-1.48,1.93,;-1.48,.38,;-2.82,-.38,;-4.15,.38,;-4.15,1.93,;-5.48,2.69,;-2.82,2.69,;-2.82,4.23,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;1.18,-4.23,;2.52,-1.93,;3.85,-2.7,;5.19,-1.93,;5.19,-.38,;6.52,.38,;3.85,.38,;2.52,-.38,;3.85,1.93,;2.52,2.69,;1.18,1.93,;2.52,4.23,;3.85,5,;5.19,4.23,;5.19,2.69,;6.52,1.93,)|
COc1ccc(F)c(-c2nc(C(=O)Nc3cnc4[C@@H](O)CCc4c3N3CCC[C@H](N)C3)c(N)s2)c1F |r|
COc1ccc(F)c(-c2nc(C(=O)Nc3cnc4[C@H](O)CCc4c3N3CCC[C@H](N)C3)c(N)s2)c1F |r|
COc1ccc(F)c(-c2nc(C(=O)Nc3cnc4[C@@H](O)CCc4c3N3C[C@H](C)C[C@H](N)C3)c(N)s2)c1F |r|
COc1ccc(F)c(-c2nc(C(=O)Nc3cnc4[C@H](O)CCc4c3N3C[C@H](C)C[C@H](N)C3)c(N)s2)c1F |r|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:24.26,34.38,(7.19,4.83,;5.85,5.6,;4.52,4.83,;3.19,5.6,;1.85,4.83,;1.85,3.29,;.52,2.52,;3.19,2.52,;4.52,3.29,;5.85,2.52,;3.19,.98,;1.85,.21,;1.85,-1.33,;3.19,-2.1,;4.52,-1.33,;4.52,.21,;5.85,.98,;.52,-2.1,;.52,-3.64,;-.82,-1.33,;-2.15,-2.1,;-2.15,-3.64,;-3.48,-4.41,;-4.82,-3.64,;-6.28,-4.11,;-6.68,-5.6,;-7.19,-2.87,;-6.28,-1.62,;-4.82,-2.1,;-3.48,-1.33,;-3.48,.21,;-2.15,.98,;-2.15,2.52,;-3.48,3.29,;-4.82,2.52,;-6.15,3.29,;-4.82,.98,)|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:34.38,wD:24.26,(7.19,4.83,;5.85,5.6,;4.52,4.83,;3.19,5.6,;1.85,4.83,;1.85,3.29,;.52,2.52,;3.19,2.52,;4.52,3.29,;5.85,2.52,;3.19,.98,;1.85,.21,;1.85,-1.33,;3.19,-2.1,;4.52,-1.33,;4.52,.21,;5.85,.98,;.52,-2.1,;.52,-3.64,;-.82,-1.33,;-2.15,-2.1,;-2.15,-3.64,;-3.48,-4.41,;-4.82,-3.64,;-6.28,-4.11,;-6.68,-5.6,;-7.19,-2.87,;-6.28,-1.62,;-4.82,-2.1,;-3.48,-1.33,;-3.48,.21,;-2.15,.98,;-2.15,2.52,;-3.48,3.29,;-4.82,2.52,;-6.15,3.29,;-4.82,.98,)|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1C[C@H](C)C[C@H](N)C1 |r,wU:24.26,35.39,32.36,(7.19,4.83,;5.85,5.6,;4.52,4.83,;3.19,5.6,;1.85,4.83,;1.85,3.29,;.52,2.52,;3.19,2.52,;4.52,3.29,;5.85,2.52,;3.19,.98,;1.85,.21,;1.85,-1.33,;3.19,-2.1,;4.52,-1.33,;4.52,.21,;5.85,.98,;.52,-2.1,;.52,-3.64,;-.82,-1.33,;-2.15,-2.1,;-2.15,-3.64,;-3.48,-4.41,;-4.82,-3.64,;-6.28,-4.11,;-6.68,-5.6,;-7.19,-2.87,;-6.28,-1.62,;-4.82,-2.1,;-3.48,-1.33,;-3.48,.21,;-2.15,.98,;-2.15,2.52,;-.82,3.29,;-3.48,3.29,;-4.82,2.52,;-6.15,3.29,;-4.82,.98,)|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1C[C@H](C)C[C@H](N)C1 |r,wU:35.39,32.36,wD:24.26,(7.19,4.83,;5.85,5.6,;4.52,4.83,;3.19,5.6,;1.85,4.83,;1.85,3.29,;.52,2.52,;3.19,2.52,;4.52,3.29,;5.85,2.52,;3.19,.98,;1.85,.21,;1.85,-1.33,;3.19,-2.1,;4.52,-1.33,;4.52,.21,;5.85,.98,;.52,-2.1,;.52,-3.64,;-.82,-1.33,;-2.15,-2.1,;-2.15,-3.64,;-3.48,-4.41,;-4.82,-3.64,;-6.28,-4.11,;-6.68,-5.6,;-7.19,-2.87,;-6.28,-1.62,;-4.82,-2.1,;-3.48,-1.33,;-3.48,.21,;-2.15,.98,;-2.15,2.52,;-.82,3.29,;-3.48,3.29,;-4.82,2.52,;-6.15,3.29,;-4.82,.98,)|
CC1(N)CCCN(C1)c1c2CCCc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F
CSc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2C(O)CCc2c1N1CCC[C@H](N)C1 |r,wU:34.38,(5.19,6.76,;3.85,5.99,;3.85,4.45,;2.52,3.68,;2.52,2.14,;1.18,1.37,;3.85,1.37,;5.19,2.14,;6.52,1.37,;5.19,3.68,;3.85,-.17,;2.52,-.94,;2.52,-2.48,;3.85,-3.25,;5.19,-2.48,;5.19,-.94,;6.52,-.17,;1.18,-3.25,;1.18,-4.79,;-.15,-2.48,;-1.48,-3.25,;-1.48,-4.79,;-2.82,-5.56,;-4.15,-4.79,;-5.61,-5.27,;-6.01,-6.76,;-6.52,-4.02,;-5.61,-2.78,;-4.15,-3.25,;-2.82,-2.48,;-2.82,-.94,;-1.48,-.17,;-1.48,1.37,;-2.82,2.14,;-4.15,1.37,;-5.48,2.14,;-4.15,-.17,)|
CSc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:34.38,wD:24.26,(5.19,6.76,;3.85,5.99,;3.85,4.45,;2.52,3.68,;2.52,2.14,;1.18,1.37,;3.85,1.37,;5.19,2.14,;6.52,1.37,;5.19,3.68,;3.85,-.17,;2.52,-.94,;2.52,-2.48,;3.85,-3.25,;5.19,-2.48,;5.19,-.94,;6.52,-.17,;1.18,-3.25,;1.18,-4.79,;-.15,-2.48,;-1.48,-3.25,;-1.48,-4.79,;-2.82,-5.56,;-4.15,-4.79,;-5.61,-5.27,;-6.01,-6.76,;-6.52,-4.02,;-5.61,-2.78,;-4.15,-3.25,;-2.82,-2.48,;-2.82,-.94,;-1.48,-.17,;-1.48,1.37,;-2.82,2.14,;-4.15,1.37,;-5.48,2.14,;-4.15,-.17,)|
CS(=O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:25.27,35.39,(5.19,6.76,;3.85,5.99,;2.52,6.76,;3.85,4.45,;2.52,3.68,;2.52,2.14,;1.18,1.37,;3.85,1.37,;5.19,2.14,;6.52,1.37,;5.19,3.68,;3.85,-.17,;2.52,-.94,;2.52,-2.48,;3.85,-3.25,;5.19,-2.48,;5.19,-.94,;6.52,-.17,;1.18,-3.25,;1.18,-4.79,;-.15,-2.48,;-1.48,-3.25,;-1.48,-4.79,;-2.82,-5.56,;-4.15,-4.79,;-5.61,-5.27,;-6.01,-6.76,;-6.52,-4.02,;-5.61,-2.78,;-4.15,-3.25,;-2.82,-2.48,;-2.82,-.94,;-1.48,-.17,;-1.48,1.37,;-2.82,2.14,;-4.15,1.37,;-5.48,2.14,;-4.15,-.17,)|
CS(=O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:35.39,wD:25.27,(5.19,6.76,;3.85,5.99,;2.52,6.76,;3.85,4.45,;2.52,3.68,;2.52,2.14,;1.18,1.37,;3.85,1.37,;5.19,2.14,;6.52,1.37,;5.19,3.68,;3.85,-.17,;2.52,-.94,;2.52,-2.48,;3.85,-3.25,;5.19,-2.48,;5.19,-.94,;6.52,-.17,;1.18,-3.25,;1.18,-4.79,;-.15,-2.48,;-1.48,-3.25,;-1.48,-4.79,;-2.82,-5.56,;-4.15,-4.79,;-5.61,-5.27,;-6.01,-6.76,;-6.52,-4.02,;-5.61,-2.78,;-4.15,-3.25,;-2.82,-2.48,;-2.82,-.94,;-1.48,-.17,;-1.48,1.37,;-2.82,2.14,;-4.15,1.37,;-5.48,2.14,;-4.15,-.17,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)S(C)=O |r,wU:12.13,3.3,1.0,(-.15,2.14,;-1.48,1.37,;-2.82,2.14,;-4.15,1.37,;-5.48,2.14,;-4.15,-.17,;-2.82,-.94,;-1.48,-.17,;-2.82,-2.48,;-4.15,-3.25,;-5.61,-2.78,;-6.52,-4.02,;-5.61,-5.27,;-6.01,-6.76,;-4.15,-4.79,;-2.82,-5.56,;-1.48,-4.79,;-1.48,-3.25,;-.15,-2.48,;1.18,-3.25,;1.18,-4.79,;2.52,-2.48,;3.85,-3.25,;5.19,-2.48,;5.19,-.94,;6.52,-.17,;3.85,-.17,;2.52,-.94,;3.85,1.37,;2.52,2.14,;1.18,1.37,;2.52,3.68,;3.85,4.45,;5.19,3.68,;5.19,2.14,;6.52,1.37,;3.85,5.99,;5.19,6.76,;2.52,6.76,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)S(C)=O |r,wU:3.3,1.0,wD:12.13,(-.15,2.14,;-1.48,1.37,;-2.82,2.14,;-4.15,1.37,;-5.48,2.14,;-4.15,-.17,;-2.82,-.94,;-1.48,-.17,;-2.82,-2.48,;-4.15,-3.25,;-5.61,-2.78,;-6.52,-4.02,;-5.61,-5.27,;-6.01,-6.76,;-4.15,-4.79,;-2.82,-5.56,;-1.48,-4.79,;-1.48,-3.25,;-.15,-2.48,;1.18,-3.25,;1.18,-4.79,;2.52,-2.48,;3.85,-3.25,;5.19,-2.48,;5.19,-.94,;6.52,-.17,;3.85,-.17,;2.52,-.94,;3.85,1.37,;2.52,2.14,;1.18,1.37,;2.52,3.68,;3.85,4.45,;5.19,3.68,;5.19,2.14,;6.52,1.37,;3.85,5.99,;5.19,6.76,;2.52,6.76,)|
CS(=O)(=O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:26.28,36.40,(5.19,6.4,;3.85,5.63,;2.52,6.4,;3.45,7.12,;3.85,4.09,;2.52,3.32,;2.52,1.78,;1.18,1.01,;3.85,1.01,;5.19,1.78,;6.52,1.01,;5.19,3.32,;3.85,-.53,;2.52,-1.3,;2.52,-2.84,;3.85,-3.61,;5.19,-2.84,;5.19,-1.3,;6.52,-.53,;1.18,-3.61,;1.18,-5.15,;-.15,-2.84,;-1.48,-3.61,;-1.48,-5.15,;-2.82,-5.92,;-4.15,-5.15,;-5.61,-5.63,;-6.01,-7.12,;-6.52,-4.38,;-5.61,-3.14,;-4.15,-3.61,;-2.82,-2.84,;-2.82,-1.3,;-1.48,-.53,;-1.48,1.01,;-2.82,1.78,;-4.15,1.01,;-5.48,1.78,;-4.15,-.53,)|
CS(=O)(=O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:36.40,wD:26.28,(5.19,6.4,;3.85,5.63,;2.52,6.4,;3.45,7.12,;3.85,4.09,;2.52,3.32,;2.52,1.78,;1.18,1.01,;3.85,1.01,;5.19,1.78,;6.52,1.01,;5.19,3.32,;3.85,-.53,;2.52,-1.3,;2.52,-2.84,;3.85,-3.61,;5.19,-2.84,;5.19,-1.3,;6.52,-.53,;1.18,-3.61,;1.18,-5.15,;-.15,-2.84,;-1.48,-3.61,;-1.48,-5.15,;-2.82,-5.92,;-4.15,-5.15,;-5.61,-5.63,;-6.01,-7.12,;-6.52,-4.38,;-5.61,-3.14,;-4.15,-3.61,;-2.82,-2.84,;-2.82,-1.3,;-1.48,-.53,;-1.48,1.01,;-2.82,1.78,;-4.15,1.01,;-5.48,1.78,;-4.15,-.53,)|
N[C@H]1CCCN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(cnc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(cnc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)C1(C)O)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:14.15,5.5,1.0,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-3.59,4.63,;-2.05,4.63,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
C[C@H]1CN(C[C@@H](N)C1(C)O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:14.15,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-3.59,4.63,;-2.05,4.63,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;2.52,3.29,;1.18,2.52,;2.52,4.83,;3.85,5.6,;5.19,4.83,;5.19,3.29,;6.52,2.52,)|
COCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1C[C@H](C)C[C@H](N)C1 |r,wU:25.27,36.40,33.37,(5.19,7.53,;5.19,5.99,;3.85,5.22,;3.85,3.68,;2.52,2.91,;2.52,1.37,;1.18,.6,;3.85,.6,;5.19,1.37,;6.52,.6,;5.19,2.91,;3.85,-.94,;2.52,-1.71,;2.52,-3.25,;3.85,-4.02,;5.19,-3.25,;5.19,-1.71,;6.52,-.94,;1.18,-4.02,;1.18,-5.56,;-.15,-3.25,;-1.48,-4.02,;-1.48,-5.56,;-2.82,-6.33,;-4.15,-5.56,;-5.61,-6.04,;-6.01,-7.53,;-6.52,-4.79,;-5.61,-3.55,;-4.15,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-1.48,-.94,;-1.48,.6,;-.15,1.37,;-2.82,1.37,;-4.15,.6,;-5.48,1.37,;-4.15,-.94,)|
COCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1C[C@H](C)C[C@H](N)C1 |r,wU:36.40,33.37,wD:25.27,(5.19,7.53,;5.19,5.99,;3.85,5.22,;3.85,3.68,;2.52,2.91,;2.52,1.37,;1.18,.6,;3.85,.6,;5.19,1.37,;6.52,.6,;5.19,2.91,;3.85,-.94,;2.52,-1.71,;2.52,-3.25,;3.85,-4.02,;5.19,-3.25,;5.19,-1.71,;6.52,-.94,;1.18,-4.02,;1.18,-5.56,;-.15,-3.25,;-1.48,-4.02,;-1.48,-5.56,;-2.82,-6.33,;-4.15,-5.56,;-5.61,-6.04,;-6.01,-7.53,;-6.52,-4.79,;-5.61,-3.55,;-4.15,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-1.48,-.94,;-1.48,.6,;-.15,1.37,;-2.82,1.37,;-4.15,.6,;-5.48,1.37,;-4.15,-.94,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCOc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)O |r,wU:5.5,1.0,wD:7.8,(-.15,1.15,;-1.48,.38,;-1.48,-1.15,;-2.82,-1.93,;-4.15,-1.15,;-4.15,.38,;-5.48,1.15,;-2.82,1.15,;-2.82,2.69,;-2.82,-3.47,;-4.15,-4.23,;-5.61,-3.76,;-6.52,-5,;-5.61,-6.25,;-4.15,-5.78,;-2.82,-6.54,;-1.48,-5.78,;-1.48,-4.23,;-.15,-3.47,;1.18,-4.23,;1.18,-5.78,;2.52,-3.47,;3.85,-4.24,;5.19,-3.47,;5.19,-1.93,;6.52,-1.15,;3.85,-1.15,;2.52,-1.93,;3.85,.38,;2.52,1.15,;1.18,.38,;2.52,2.69,;3.85,3.47,;5.19,2.69,;5.19,1.15,;6.52,.38,;3.85,5,;2.52,5.78,;3.85,6.54,;5.19,5.77,)|
COCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2C(O)CCc2c1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:37.41,33.37,wD:35.39,(5.19,7.53,;5.19,5.99,;3.85,5.22,;3.85,3.68,;2.52,2.91,;2.52,1.37,;1.18,.6,;3.85,.6,;5.19,1.37,;6.52,.6,;5.19,2.91,;3.85,-.94,;2.52,-1.71,;2.52,-3.25,;3.85,-4.02,;5.19,-3.25,;5.19,-1.71,;6.52,-.94,;1.18,-4.02,;1.18,-5.56,;-.15,-3.25,;-1.48,-4.02,;-1.48,-5.56,;-2.82,-6.33,;-4.15,-5.56,;-5.61,-6.04,;-6.01,-7.53,;-6.52,-4.79,;-5.61,-3.55,;-4.15,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-1.48,-.94,;-1.48,.6,;-.15,1.37,;-2.82,1.37,;-2.82,2.91,;-4.15,.6,;-5.48,1.37,;-4.15,-.94,)|
COCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:37.41,33.37,wD:35.39,25.27,(5.19,7.53,;5.19,5.99,;3.85,5.22,;3.85,3.68,;2.52,2.91,;2.52,1.37,;1.18,.6,;3.85,.6,;5.19,1.37,;6.52,.6,;5.19,2.91,;3.85,-.94,;2.52,-1.71,;2.52,-3.25,;3.85,-4.02,;5.19,-3.25,;5.19,-1.71,;6.52,-.94,;1.18,-4.02,;1.18,-5.56,;-.15,-3.25,;-1.48,-4.02,;-1.48,-5.56,;-2.82,-6.33,;-4.15,-5.56,;-5.61,-6.04,;-6.01,-7.53,;-6.52,-4.79,;-5.61,-3.55,;-4.15,-4.02,;-2.82,-3.25,;-2.82,-1.71,;-1.48,-.94,;-1.48,.6,;-.15,1.37,;-2.82,1.37,;-2.82,2.91,;-4.15,.6,;-5.48,1.37,;-4.15,-.94,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)O |r,wU:3.3,1.0,12.13,(-.15,1.75,;-1.48,.98,;-2.82,1.75,;-4.15,.98,;-5.48,1.75,;-4.15,-.56,;-2.82,-1.33,;-1.48,-.56,;-2.82,-2.87,;-4.15,-3.64,;-5.61,-3.16,;-6.52,-4.41,;-5.61,-5.65,;-6.01,-7.14,;-4.15,-5.18,;-2.82,-5.95,;-1.48,-5.18,;-1.48,-3.64,;-.15,-2.87,;1.18,-3.64,;1.18,-5.18,;2.52,-2.87,;3.85,-3.64,;5.19,-2.87,;5.19,-1.33,;6.52,-.56,;3.85,-.56,;2.52,-1.33,;3.85,.98,;2.52,1.75,;1.18,.98,;2.52,3.29,;3.85,4.06,;5.19,3.29,;5.19,1.75,;6.52,.98,;3.85,5.6,;2.52,6.37,;3.85,7.14,;5.19,6.37,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(cc1F)C(C)(C)O |r,wU:3.3,1.0,wD:12.13,(-.15,1.75,;-1.48,.98,;-2.82,1.75,;-4.15,.98,;-5.48,1.75,;-4.15,-.56,;-2.82,-1.33,;-1.48,-.56,;-2.82,-2.87,;-4.15,-3.64,;-5.61,-3.16,;-6.52,-4.41,;-5.61,-5.65,;-6.01,-7.14,;-4.15,-5.18,;-2.82,-5.95,;-1.48,-5.18,;-1.48,-3.64,;-.15,-2.87,;1.18,-3.64,;1.18,-5.18,;2.52,-2.87,;3.85,-3.64,;5.19,-2.87,;5.19,-1.33,;6.52,-.56,;3.85,-.56,;2.52,-1.33,;3.85,.98,;2.52,1.75,;1.18,.98,;2.52,3.29,;3.85,4.06,;5.19,3.29,;5.19,1.75,;6.52,.98,;3.85,5.6,;2.52,6.37,;3.85,7.14,;5.19,6.37,)|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,15.17,wD:9.11,(-5.56,3.11,;-4.23,2.34,;-4.23,.8,;-2.89,.03,;-1.56,.8,;-1.56,2.34,;-.23,3.11,;1.31,3.11,;.54,4.44,;-2.89,3.11,;-2.89,4.65,;-2.89,-1.51,;-4.23,-2.28,;-5.69,-1.81,;-6.6,-3.05,;-5.69,-4.3,;-6.09,-5.79,;-4.23,-3.82,;-2.89,-4.59,;-1.56,-3.82,;-1.56,-2.28,;-.23,-1.51,;1.26,-1.91,;1.26,-3.45,;2.6,-1.14,;3.93,-1.91,;5.26,-1.14,;5.26,.4,;6.6,1.17,;3.93,1.17,;2.6,.4,;3.93,2.71,;2.6,3.48,;1.26,2.71,;2.6,5.02,;3.93,5.79,;5.26,5.02,;5.26,3.48,;6.6,2.71,)|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,5.5,wD:15.17,9.11,(-5.56,3.11,;-4.23,2.34,;-4.23,.8,;-2.89,.03,;-1.56,.8,;-1.56,2.34,;-.23,3.11,;1.31,3.11,;.54,4.44,;-2.89,3.11,;-2.89,4.65,;-2.89,-1.51,;-4.23,-2.28,;-5.69,-1.81,;-6.6,-3.05,;-5.69,-4.3,;-6.09,-5.79,;-4.23,-3.82,;-2.89,-4.59,;-1.56,-3.82,;-1.56,-2.28,;-.23,-1.51,;1.26,-1.91,;1.26,-3.45,;2.6,-1.14,;3.93,-1.91,;5.26,-1.14,;5.26,.4,;6.6,1.17,;3.93,1.17,;2.6,.4,;3.93,2.71,;2.6,3.48,;1.26,2.71,;2.6,5.02,;3.93,5.79,;5.26,5.02,;5.26,3.48,;6.6,2.71,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCOc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:5.5,1.0,wD:7.8,(-.82,.38,;-2.15,-.38,;-2.15,-1.93,;-3.48,-2.69,;-4.82,-1.93,;-4.82,-.38,;-6.15,.38,;-3.48,.38,;-3.48,1.93,;-3.48,-4.23,;-4.82,-5,;-6.28,-4.53,;-7.19,-5.78,;-6.28,-7.02,;-4.82,-6.54,;-3.48,-7.31,;-2.15,-6.54,;-2.15,-5,;-.82,-4.23,;.52,-5,;.52,-6.54,;1.85,-4.23,;3.19,-5,;4.52,-4.23,;4.52,-2.69,;5.85,-1.93,;3.19,-1.93,;1.85,-2.69,;3.19,-.38,;1.85,.39,;.52,-.38,;1.85,1.93,;3.19,2.69,;3.19,4.23,;4.52,5,;4.52,6.54,;5.85,7.31,;7.19,6.54,;7.19,5,;5.85,4.23,;4.52,1.93,;4.52,.39,;5.85,-.38,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:3.3,1.0,12.13,(-.82,.98,;-2.15,.21,;-3.48,.98,;-4.82,.21,;-6.15,.98,;-4.82,-1.33,;-3.48,-2.1,;-2.15,-1.33,;-3.48,-3.64,;-4.82,-4.41,;-6.28,-3.93,;-7.19,-5.18,;-6.28,-6.42,;-6.68,-7.91,;-4.82,-5.95,;-3.48,-6.72,;-2.15,-5.95,;-2.15,-4.41,;-.82,-3.64,;.52,-4.41,;.52,-5.95,;1.85,-3.64,;3.19,-4.41,;4.52,-3.64,;4.52,-2.1,;5.85,-1.33,;3.19,-1.33,;1.85,-2.1,;3.19,.21,;1.85,.98,;.52,.21,;1.85,2.52,;3.19,3.29,;3.19,4.83,;4.52,5.6,;4.52,7.14,;5.85,7.91,;7.19,7.14,;7.19,5.6,;5.85,4.83,;4.52,2.52,;4.52,.98,;5.85,.21,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:3.3,1.0,wD:12.13,(-.82,.98,;-2.15,.21,;-3.48,.98,;-4.82,.21,;-6.15,.98,;-4.82,-1.33,;-3.48,-2.1,;-2.15,-1.33,;-3.48,-3.64,;-4.82,-4.41,;-6.28,-3.93,;-7.19,-5.18,;-6.28,-6.42,;-6.68,-7.91,;-4.82,-5.95,;-3.48,-6.72,;-2.15,-5.95,;-2.15,-4.41,;-.82,-3.64,;.52,-4.41,;.52,-5.95,;1.85,-3.64,;3.19,-4.41,;4.52,-3.64,;4.52,-2.1,;5.85,-1.33,;3.19,-1.33,;1.85,-2.1,;3.19,.21,;1.85,.98,;.52,.21,;1.85,2.52,;3.19,3.29,;3.19,4.83,;4.52,5.6,;4.52,7.14,;5.85,7.91,;7.19,7.14,;7.19,5.6,;5.85,4.83,;4.52,2.52,;4.52,.98,;5.85,.21,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCOc2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.15,2.69,;-1.48,1.93,;-1.48,.38,;-2.82,-.38,;-4.15,.38,;-4.15,1.93,;-5.48,2.69,;-2.82,2.69,;-2.82,4.23,;-2.82,-1.93,;-4.15,-2.69,;-5.61,-2.22,;-6.52,-3.47,;-5.61,-4.71,;-4.15,-4.23,;-2.82,-5,;-1.48,-4.23,;-1.48,-2.69,;-.15,-1.93,;1.18,-2.69,;1.18,-4.23,;2.52,-1.93,;2.52,-.38,;3.85,.38,;5.19,-.38,;6.52,.38,;5.19,-1.93,;3.85,-2.69,;3.85,-4.23,;3.85,1.93,;2.52,2.7,;1.18,1.93,;2.52,4.24,;3.85,5,;5.19,4.24,;5.19,2.7,;6.52,1.93,)|
CC(C)(O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1C[C@@H](N)C[C@H](C1)C(F)(F)F |r,wU:34.38,37.43,26.28,(7.85,-2.21,;7.85,-3.75,;7.85,-5.29,;9.19,-2.98,;6.52,-2.98,;6.52,-1.44,;5.19,-.67,;5.19,.87,;3.85,-1.44,;3.85,-2.98,;2.52,-3.75,;5.19,-3.75,;2.52,-.67,;1.18,-1.44,;-.15,-.67,;-.15,.87,;1.18,1.64,;2.52,.87,;3.85,1.64,;-1.48,-1.44,;-1.48,-2.98,;-2.82,-.67,;-4.15,-1.44,;-4.15,-2.98,;-5.48,-3.75,;-6.82,-2.98,;-8.28,-3.45,;-8.68,-4.94,;-9.19,-2.21,;-8.28,-.96,;-6.82,-1.44,;-5.48,-.67,;-5.48,.87,;-6.82,1.64,;-6.82,3.18,;-8.15,3.95,;-5.48,3.95,;-4.15,3.18,;-4.15,1.64,;-2.82,3.95,;-1.48,4.72,;-2.05,2.62,;-3.59,5.29,)|
CC(C)(O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@H](O)CCc2c1N1C[C@@H](N)C[C@H](C1)C(F)(F)F |r,wU:34.38,37.43,wD:26.28,(7.85,-2.21,;7.85,-3.75,;7.85,-5.29,;9.19,-2.98,;6.52,-2.98,;6.52,-1.44,;5.19,-.67,;5.19,.87,;3.85,-1.44,;3.85,-2.98,;2.52,-3.75,;5.19,-3.75,;2.52,-.67,;1.18,-1.44,;-.15,-.67,;-.15,.87,;1.18,1.64,;2.52,.87,;3.85,1.64,;-1.48,-1.44,;-1.48,-2.98,;-2.82,-.67,;-4.15,-1.44,;-4.15,-2.98,;-5.48,-3.75,;-6.82,-2.98,;-8.28,-3.45,;-8.68,-4.94,;-9.19,-2.21,;-8.28,-.96,;-6.82,-1.44,;-5.48,-.67,;-5.48,.87,;-6.82,1.64,;-6.82,3.18,;-8.15,3.95,;-5.48,3.95,;-4.15,3.18,;-4.15,1.64,;-2.82,3.95,;-1.48,4.72,;-2.05,2.62,;-3.59,5.29,)|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnc2OCCc2c1N1C[C@H](C)C[C@H](N)C1 |r,wU:34.38,31.35,(7.19,4.24,;5.85,5.01,;4.52,4.24,;3.19,5,;1.85,4.24,;1.85,2.7,;.52,1.93,;3.19,1.92,;4.52,2.7,;5.85,1.93,;3.19,.38,;1.85,-.39,;1.85,-1.93,;3.19,-2.7,;4.52,-1.93,;4.52,-.39,;5.85,.38,;.52,-2.7,;.52,-4.24,;-.82,-1.93,;-2.15,-2.7,;-2.15,-4.24,;-3.48,-5.01,;-4.82,-4.24,;-6.28,-4.71,;-7.19,-3.47,;-6.28,-2.22,;-4.82,-2.7,;-3.48,-1.93,;-3.48,-.39,;-2.15,.38,;-2.15,1.92,;-.82,2.69,;-3.48,2.69,;-4.82,1.92,;-6.15,2.69,;-4.82,.38,)|
COc1ccc(F)c(c1F)-c1nc(ccc1F)C(=O)Nc1cnc2OCCc2c1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:35.39,31.35,wD:33.37,(7.19,4.24,;5.85,5.01,;4.52,4.24,;3.19,5,;1.85,4.24,;1.85,2.7,;.52,1.93,;3.19,1.92,;4.52,2.7,;5.85,1.93,;3.19,.38,;1.85,-.39,;1.85,-1.93,;3.19,-2.7,;4.52,-1.93,;4.52,-.39,;5.85,.38,;.52,-2.7,;.52,-4.24,;-.82,-1.93,;-2.15,-2.7,;-2.15,-4.24,;-3.48,-5.01,;-4.82,-4.24,;-6.28,-4.71,;-7.19,-3.47,;-6.28,-2.22,;-4.82,-2.7,;-3.48,-1.93,;-3.48,-.39,;-2.15,.38,;-2.15,1.92,;-.82,2.69,;-3.48,2.69,;-3.48,4.23,;-4.82,1.92,;-6.15,2.69,;-4.82,.38,)|
C[C@H]1CN(C[C@@H](N)[C@@]1(C)O)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)[C@]1(C)O)c1c2CCOc2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
Cn1ncc(NC(=O)c2c(N)sc3cccnc23)c1N1CCCC(N)CC1
Cn1ncc(NC(=O)c2c(N)sc3cccnc23)c1N1CCC[C@H](N)C1 |r|
Cn1ncc(NC(=O)c2c(N)sc3cccnc23)c1N1CCC[C@@H](N)C1 |r|
Cn1ncc(NC(=O)c2c(N)sc3cccnc23)c1N1CCCNCC1
Cn1ncc(NC(=O)c2c(N)sc3cccnc23)c1-c1ccc2CCC(N)c2c1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cccnc12 |r|
N[C@@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cccnc12 |r|
Nc1sc2cccnc2c1C(=O)Nc1cnccc1N1CCCNCC1
NC1CCCN(CC1)c1ccncc1NC(=O)c1c(N)sc2cccnc12
COc1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc2c1 |r|
COc1cnc2c(C(=O)Nc3cnn(C)c3C3CCCC(N)CC3)c(N)sc2c1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cc(OC3CC3)cnc12 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)sc2cccnc12 |r|
COc1ccnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc12 |r|
COc1ccnc2c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c(N)sc12
CC(C)Oc1ccnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc12 |r|
CC(C)Oc1ccnc2c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c(N)sc12
CCOc1ccnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc12 |r|
CCc1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc2c1 |r|
CCc1cnc2c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c(N)sc2c1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cc(cnc12)-c1ccccc1 |r|
Cn1ncc(NC(=O)c2c(N)sc3cc(cnc23)-c2ccccc2)c1N1CCCC(N)CC1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cc(cnc12)-c1c(F)cccc1F |r|
Cn1ncc(NC(=O)c2c(N)sc3cc(cnc23)-c2c(F)cccc2F)c1N1CCCC(N)CC1
Cc1noc(C)c1-c1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc2c1 |r|
Cc1noc(C)c1-c1cnc2c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c(N)sc2c1
Cn1ncc(NC(=O)c2c(N)sc3cc(cnc23)-c2nccs2)c1N1CCCC(N)CC1
CN1CC(C1)c1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc2c1 |r|
CN1CC(C1)c1cnc2c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c(N)sc2c1
CC(C)N1CC(C1)c1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc2c1 |r|
COCc1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)sc2c1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cc(cnc12)C1CCOCC1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2cc(F)cnc12 |r|
Cn1ncc(NC(=O)c2c(N)sc3cc(F)cnc23)c1N1CCCC(N)CC1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2c(ccnc12)C(F)(F)F |r|
Cn1ncc(NC(=O)c2c(N)sc3ccc(Cl)nc23)c1N1CCCC(N)CC1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)sc2ccc(Cl)nc12 |r|
Cn1ncc(NC(=O)c2c(N)sc3ccc(Cl)nc23)c1N1CCC[C@H](N)C1 |r|
Cc1ccc2sc(N)c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c2n1 |r|
Cc1ccc2sc(N)c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c2n1
Cn1ncc(NC(=O)c2c(N)sc3ccc(nc23)-c2ccccc2)c1N1CCCC(N)CC1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
Cn1ncc(NC(=O)c2c(N)oc3cccnc23)c1N1CCCC(N)CC1
CCc1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)oc2c1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C(F)(F)F |r|
Cc1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)oc2c1 |r|
CC(C)c1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)oc2c1 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)oc2c1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(F)cnc12 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(Cl)cnc12 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(Br)cnc12 |r|
Cc1ccnc2c(C(=O)Nc3cnccc3N3CCC[C@H](N)C3)c(N)oc12 |r|
Cn1ncc(NC(=O)c2c(N)oc3cc(cnc23)C(F)(F)F)c1N1CCCC(N)CC1
Cn1ncc(NC(=O)c2c(N)oc3cc(Cl)cnc23)c1N1CCCC(N)CC1
Cn1ncc(NC(=O)c2c(N)oc3c(Cl)ccnc23)c1N1CCCC(N)CC1
CCCc1cnc2c(C(=O)Nc3cnn(C)c3N3CCCC(N)CC3)c(N)oc2c1
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cccnc12)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C(F)(F)F)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(Cl)cnc12)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(F)cnc12)C(F)(F)F |r|
Cc1cncc(NC(=O)c2c(N)oc3cccnc23)c1N1CC[C@H](N)C1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(Cl)cnc12 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@H](O)[C@H](N)C3)c(N)oc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C(F)(F)F |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)C[C@H](N)C3)c(N)oc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(F)cnc12 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(Cl)cnc12 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C(F)(F)F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
CC(C)c1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@H](O)[C@H](N)C3)c(N)oc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c(C)cncc1NC(=O)c1c(N)oc2cccnc12 |r|
CCCc1cnc2c(C(=O)Nc3cncc(C)c3N3C[C@H](C)[C@@H](O)[C@H](N)C3)c(N)oc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c(C)cncc1NC(=O)c1c(N)oc2cc(Cl)cnc12 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c(C)cncc1NC(=O)c1c(N)oc2cc(cnc12)C(F)(F)F |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3CC[C@@H](F)[C@H](N)C3)c(N)oc2c1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1c(N)oc2c(Cl)ccnc12 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)[C@H](O)[C@H](C3)C3CC3)c(N)oc2c1 |r|
C[C@H]1C[C@H](C[C@@H](N)[C@]1(C)O)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3[C@@H]3C[C@H](C)[C@@](C)(O)[C@H](N)C3)c(N)oc2c1 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@](C)(O)[C@H](N)C3)c(N)oc2c1 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@](C)(O)[C@H](N)C3)c(N)oc2c1 |r|
N[C@@H]1CN(C[C@@H]([C@H]1O)C(F)(F)F)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
N[C@@H]1CN(C[C@@H]([C@@H]1O)C(F)(F)F)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
N[C@H]1CCCN(C1)c1sncc1NC(=O)c1c(N)sc2cccnc12 |r|
CC(C)c1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)[C@H](O)[C@H](C3)C3CC3)c(N)oc2c1 |r|
Cn1ncc(NC(=O)c2c(N)oc3cc(cnc23)C2CCOCC2)c1N1C[C@@H](N)C[C@H](C1)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1sncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCOCC1)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCOCC1)C(F)(F)F |r|
CN1CCC(CC1)c1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
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C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCOCC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1sncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCOCC1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCC1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCC1)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CN3CC(F)C3)cnc12)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CN3CC(F)(F)C3)cnc12)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CN3CC(O)C3)cnc12)C(F)(F)F |r|
CC(C)c1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@H]([C@H](N)C3)n3ccnn3)c(N)oc2c1 |r|
COC1CCN(Cc2cnc3c(C(=O)Nc4cnccc4N4C[C@@H](N)C[C@H](C4)C(F)(F)F)c(N)oc3c2)C1 |r|
CCOC1CCN(Cc2cnc3c(C(=O)Nc4cnccc4N4C[C@@H](N)C[C@H](C4)C(F)(F)F)c(N)oc3c2)C1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CN3CC[C@@H](F)C3)cnc12)C(F)(F)F |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CN3CC[C@H](F)C3)cnc12)C(F)(F)F |r|
COC1CCN(Cc2cnc3c(C(=O)Nc4cnccc4N4C[C@@H](N)C[C@H](C4)C(F)(F)F)c(N)oc3c2)CC1 |r|
CN1CCN(Cc2cnc3c(C(=O)Nc4cnccc4N4C[C@@H](N)C[C@H](C4)C(F)(F)F)c(N)oc3c2)CC1 |r|
Cn1cc(cn1)-c1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)-c1cnn(C)c1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)-c1cncnc1)C(F)(F)F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)-c1cncnc1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CC1)C(F)(F)F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CC1 |r|
Cc1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(C)cnc12 |r|
CCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)C[C@H](N)C3)c(N)oc2c1 |r|
CCc1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(OC(F)F)cnc12 |r|
CC(C)Oc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)C[C@H](N)C3)c(N)oc2c1 |r|
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCOC1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCOC1)C(F)(F)F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCC1 |r|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CCC1 |r|
CNC(=O)c1ccc(cn1)-c1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
CNC(=O)c1ccc(cn1)-c1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)C[C@H](N)C3)c(N)oc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CC1 |r|
N[C@@H]1CN(C[C@H](C2CC2)[C@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C(F)(F)F |r|
CC(C)c1cnc2c(C(=O)Nc3cnccc3C3C[C@H](C)C[C@H](N)C3)c(N)oc2c1 |r|
COCCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CCCN3CCOCC3)cnc12)C(F)(F)F |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1c(N)oc2cc(cnc12)C1CC1 |r|
COCCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)C[C@H](N)C3)c(N)oc2c1 |r|
CN(C)CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@@H](N)C[C@H](C3)C(F)(F)F)c(N)oc2c1 |r|
N[C@@H]1C[C@@H](C[C@@H](C1)C(F)(F)F)c1ccncc1NC(=O)c1c(N)oc2cccnc12 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)oc2cc(CCCF)cnc12 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)oc2cc(CCN3CC[C@@H](F)C3)cnc12)C(F)(F)F |r|
CC(C)c1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@H](O)[C@H](N)C3)c(N)sc2c1 |r|
CCCc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@H](O)[C@H](N)C3)c(N)sc2c1 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)sc2cc(NC(C)=O)cnc12 |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1NC(=O)c1c(N)sc2cc(NC(=O)C3CC3)cnc12 |r|
CC(C)C(=O)Nc1cnc2c(C(=O)Nc3cnccc3N3C[C@H](C)[C@@H](O)[C@H](N)C3)c(N)sc2c1 |r|
N[C@H]1C[C@H](CN(C1)c1ccncc1NC(=O)c1c(N)sc2cc(cnc12)N1CCOCC1)C(F)(F)F |r|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCC(O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.15,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-4.15,2.51,;-5.48,3.28,;-2.82,3.28,;-2.82,4.82,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;5.19,3.28,;6.52,2.51,;5.19,4.82,;3.85,5.59,;2.52,4.82,;2.52,3.28,;1.18,2.51,)|
CSc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1CCC[C@H](N)C1 |r,wU:34.38,24.26,(5.19,6.68,;3.85,5.91,;3.85,4.37,;2.52,3.6,;2.52,2.06,;1.18,1.29,;3.85,1.29,;5.19,2.06,;6.52,1.29,;5.19,3.6,;3.85,-.25,;2.52,-1.02,;2.52,-2.56,;3.85,-3.33,;5.19,-2.56,;5.19,-1.02,;6.52,-.25,;1.18,-3.33,;1.18,-4.87,;-.15,-2.56,;-1.48,-3.33,;-1.48,-4.87,;-2.82,-5.64,;-4.15,-4.87,;-5.61,-5.35,;-6.38,-6.68,;-6.52,-4.1,;-5.61,-2.85,;-4.15,-3.33,;-2.82,-2.56,;-2.82,-1.02,;-1.48,-.25,;-1.48,1.29,;-2.82,2.06,;-4.15,1.29,;-5.48,2.06,;-4.15,-.25,)|
C[C@H]1CN(C[C@@H](N)[C@@]1(C)O)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.9,14.15,wD:7.8,(-.15,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-4.15,2.51,;-5.48,3.28,;-2.82,3.28,;-3.59,4.61,;-2.05,4.61,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;2.52,3.28,;1.18,2.51,;2.52,4.82,;3.85,5.59,;5.19,4.82,;5.19,3.28,;6.52,2.51,)|
C[C@H]1CN(C[C@@H](N)[C@@]1(C)O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.9,wD:7.8,14.15,(-.15,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-4.15,2.51,;-5.48,3.28,;-2.82,3.28,;-3.59,4.61,;-2.05,4.61,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;2.52,3.28,;1.18,2.51,;2.52,4.82,;3.85,5.59,;5.19,4.82,;5.19,3.28,;6.52,2.51,)|
C[C@H]1CN(C[C@@H](N)[C@]1(C)O)c1c2CC[C@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,14.15,wD:7.9,(-.15,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-4.15,2.51,;-5.48,3.28,;-2.82,3.28,;-3.59,4.61,;-2.05,4.61,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;2.52,3.28,;1.18,2.51,;2.52,4.82,;3.85,5.59,;5.19,4.82,;5.19,3.28,;6.52,2.51,)|
C[C@H]1CN(C[C@@H](N)[C@]1(C)O)c1c2CC[C@@H](O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,7.8,wD:7.9,14.15,(-.15,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-4.15,2.51,;-5.48,3.28,;-2.82,3.28,;-3.59,4.61,;-2.05,4.61,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;2.52,3.28,;1.18,2.51,;2.52,4.82,;3.85,5.59,;5.19,4.82,;5.19,3.28,;6.52,2.51,)|
COCc1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2[C@@H](O)CCc2c1N1C[C@H](C)[C@@H](O)[C@H](N)C1 |r,wU:25.27,33.37,37.41,wD:35.39,(5.19,7.45,;5.19,5.91,;3.85,5.14,;3.85,3.6,;5.19,2.83,;5.19,1.29,;6.52,.52,;3.85,.52,;2.52,1.29,;1.18,.52,;2.52,2.83,;3.85,-1.02,;2.52,-1.79,;2.52,-3.33,;3.85,-4.1,;5.19,-3.33,;5.19,-1.79,;6.52,-1.02,;1.18,-4.1,;1.18,-5.64,;-.15,-3.33,;-1.48,-4.1,;-1.48,-5.64,;-2.82,-6.41,;-4.15,-5.64,;-5.61,-6.12,;-6.38,-7.45,;-6.52,-4.87,;-5.61,-3.62,;-4.15,-4.1,;-2.82,-3.33,;-2.82,-1.79,;-1.48,-1.02,;-1.48,.52,;-.15,1.29,;-2.82,1.29,;-2.82,2.83,;-4.15,.52,;-5.48,1.29,;-4.15,-1.02,)|
N[C@H]1CCCN(C1)c1c2CCC(O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,(-5.48,3.28,;-4.15,2.51,;-2.82,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;2.52,3.28,;1.18,2.51,;2.52,4.82,;3.85,5.59,;5.19,4.82,;5.19,3.28,;6.52,2.51,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@H](O)c2ncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1c2CC[C@@H](O)c2ncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@H]1CN(C[C@@H](N)C1(C)O)c1c2CCC(O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:5.5,1.0,(-.15,3.28,;-1.48,2.51,;-1.48,.97,;-2.82,.2,;-4.15,.97,;-4.15,2.51,;-5.48,3.28,;-2.82,3.28,;-3.59,4.61,;-2.05,4.61,;-2.82,-1.34,;-4.15,-2.11,;-5.61,-1.63,;-6.52,-2.88,;-5.61,-4.13,;-6.09,-5.59,;-4.15,-3.65,;-2.82,-4.42,;-1.48,-3.65,;-1.48,-2.11,;-.15,-1.34,;1.18,-2.11,;1.18,-3.65,;2.52,-1.34,;3.85,-2.11,;5.19,-1.34,;5.19,.2,;6.52,.97,;3.85,.97,;2.52,.2,;3.85,2.51,;2.52,3.28,;1.18,2.51,;2.52,4.82,;3.85,5.59,;5.19,4.82,;5.19,3.28,;6.52,2.51,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCNc2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cc(OC2CCCOC2)cc1F |r,wU:1.0,5.5,wD:7.8,(-.82,.39,;-2.15,-.38,;-2.15,-1.93,;-3.48,-2.69,;-4.82,-1.93,;-4.82,-.38,;-6.15,.38,;-3.48,.38,;-3.48,1.93,;-3.48,-4.23,;-4.82,-5,;-6.28,-4.53,;-7.19,-5.78,;-6.28,-7.02,;-4.82,-6.54,;-3.48,-7.31,;-2.15,-6.54,;-2.15,-5,;-.82,-4.23,;.52,-5,;.52,-6.54,;1.85,-4.23,;3.19,-5,;4.52,-4.23,;4.52,-2.69,;5.85,-1.93,;3.19,-1.93,;1.85,-2.69,;3.19,-.38,;1.85,.38,;.52,-.38,;1.85,1.93,;3.19,2.69,;3.19,4.23,;4.52,5,;4.52,6.54,;5.85,7.31,;7.19,6.54,;7.19,5,;5.85,4.23,;4.52,1.93,;4.52,.38,;5.85,-.38,)|
N[C@H]1CCCN(C1)c1c2CCC(O)c2ncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1c2CCC(C#N)c2ncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@@H]1C[C@H](N)CN(C1)c1c2CCC(O)c2ncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.15,3.29,;-1.48,2.52,;-2.82,3.29,;-4.15,2.52,;-5.48,3.29,;-4.15,.98,;-2.82,.21,;-1.48,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;3.85,-2.1,;5.19,-1.33,;5.19,.21,;6.52,.98,;3.85,.98,;2.52,.21,;3.85,2.52,;5.19,3.29,;6.52,2.52,;5.19,4.83,;3.85,5.6,;2.52,4.83,;2.52,3.29,;1.18,2.52,)|
C[C@@H]1C[C@H](N)CN(C1)c1c2CCC(O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:3.3,1.0,(-.15,3.29,;-1.48,2.52,;-2.82,3.29,;-4.15,2.52,;-5.48,3.29,;-4.15,.98,;-2.82,.21,;-1.48,.98,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;5.19,3.29,;6.52,2.52,;5.19,4.83,;3.85,5.6,;2.52,4.83,;2.52,3.29,;1.18,2.52,)|
C[C@H]1CN(C[C@@H](N)[C@@H]1O)c1c2CCC(O)c2ncc1NC(=O)c1nc(c(F)cc1N)-c1c(F)cccc1F |r,wU:5.5,1.0,wD:7.8,(-.15,3.29,;-1.48,2.52,;-1.48,.98,;-2.82,.21,;-4.15,.98,;-4.15,2.52,;-5.48,3.29,;-2.82,3.29,;-2.82,4.83,;-2.82,-1.33,;-4.15,-2.1,;-5.61,-1.62,;-6.52,-2.87,;-5.61,-4.11,;-6.01,-5.6,;-4.15,-3.64,;-2.82,-4.41,;-1.48,-3.64,;-1.48,-2.1,;-.15,-1.33,;1.18,-2.1,;1.18,-3.64,;2.52,-1.33,;2.52,.21,;3.85,.98,;5.19,.21,;6.52,.98,;5.19,-1.33,;3.85,-2.1,;3.85,-3.64,;3.85,2.52,;5.19,3.29,;6.52,2.52,;5.19,4.83,;3.85,5.6,;2.52,4.83,;2.52,3.29,;1.18,2.52,)|
COc1ccc(F)c(-c2nc(C(=O)Nc3cnc4C(O)CCc4c3N3CCC[C@H](N)C3)c(N)s2)c1F |r|
COc1ccc(F)c(-c2nc(C(=O)Nc3cnc4C(O)CCc4c3N3C[C@H](C)C[C@H](N)C3)c(N)s2)c1F |r|
CC(C)(O)c1cc(F)c(c(F)c1)-c1nc(ccc1F)C(=O)Nc1cnc2C(O)CCc2c1N1C[C@@H](N)C[C@H](C1)C(F)(F)F |r,wU:34.38,37.43,(7.85,-5.29,;7.85,-3.75,;7.85,-2.21,;9.19,-2.98,;6.52,-2.98,;6.52,-1.44,;5.19,-.67,;5.19,.87,;3.85,-1.44,;3.85,-2.98,;2.52,-3.75,;5.19,-3.75,;2.52,-.67,;1.18,-1.44,;-.15,-.67,;-.15,.87,;1.18,1.64,;2.52,.87,;3.85,1.64,;-1.48,-1.44,;-1.48,-2.98,;-2.82,-.67,;-4.15,-1.44,;-4.15,-2.98,;-5.48,-3.75,;-6.82,-2.98,;-8.28,-3.45,;-8.68,-4.94,;-9.19,-2.21,;-8.28,-.96,;-6.82,-1.44,;-5.48,-.67,;-5.48,.87,;-6.82,1.64,;-6.82,3.18,;-8.15,3.95,;-5.48,3.95,;-4.15,3.18,;-4.15,1.64,;-2.82,3.95,;-1.48,4.72,;-3.59,5.29,;-2.05,2.62,)|
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2ncc(-c3cccs3)n2n1 |r,wU:7.10,wD:4.3,(-7.04,1.83,;-5.7,2.6,;-5.7,4.14,;-7.04,3.37,;-4.37,1.83,;-4.37,.29,;-3.04,-.48,;-1.7,.29,;-1.7,1.83,;-3.04,2.6,;-.37,-.48,;.96,.29,;.96,1.83,;2.3,2.6,;3.63,1.83,;5.1,2.31,;6,1.06,;5.1,-.18,;5.57,-1.65,;4.67,-2.9,;5.57,-4.14,;7.04,-3.67,;7.04,-2.13,;3.63,.29,;2.3,-.48,)|
FC(F)(F)c1cccc(c1)-c1cnc2ccc(NCC3CC4(C3)CCNCC4)nn12
FC(F)(F)c1cccc(c1)-c1cnc2ccc(NC3CC4(C3)CCNCC4)nn12
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2ncc(-c3nccs3)n2n1 |r,wU:7.10,wD:4.3,(-7.04,1.83,;-5.7,2.6,;-5.7,4.14,;-7.04,3.37,;-4.37,1.83,;-4.37,.29,;-3.04,-.48,;-1.7,.29,;-1.7,1.83,;-3.04,2.6,;-.37,-.48,;.96,.29,;.96,1.83,;2.3,2.6,;3.63,1.83,;5.1,2.31,;6,1.06,;5.1,-.18,;5.57,-1.65,;4.67,-2.9,;5.57,-4.14,;7.04,-3.67,;7.04,-2.13,;3.63,.29,;2.3,-.48,)|
FC(F)(F)c1cccc(c1)-c1cnc2ccc(NCC3CC4(C3)CCNC4)nn12 |(9.02,-2.76,;7.51,-2.44,;7.19,-3.94,;7.83,-.93,;6.01,-2.12,;4.92,-3.25,;3.41,-2.93,;2.94,-1.46,;3.97,-.32,;5.48,-.64,;3.49,1.15,;4.4,2.39,;3.49,3.64,;2.03,3.16,;.69,3.93,;-.64,3.16,;-.64,1.62,;-1.97,.85,;-3.31,1.62,;-4.64,.85,;-6.13,1.25,;-6.53,-.24,;-5.04,-.64,;-6.69,-1.77,;-8.19,-2.09,;-8.96,-.76,;-7.93,.39,;.69,.85,;2.03,1.62,)|
FC(F)(F)c1cccc(c1)-c1cnc2ccc(NC3CCCNCC3)nn12
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2ncc(-c3ccc(s3)C(F)(F)F)n2n1 |r,wU:7.10,wD:4.3,(-8.28,2.67,;-6.95,3.44,;-6.95,4.98,;-8.28,4.21,;-5.62,2.67,;-5.62,1.13,;-4.28,.36,;-2.95,1.13,;-2.95,2.67,;-4.28,3.44,;-1.61,.36,;-.28,1.13,;-.28,2.67,;1.05,3.44,;2.39,2.67,;3.85,3.14,;4.76,1.9,;3.85,.65,;4.33,-.81,;3.42,-2.06,;4.33,-3.3,;5.82,-2.85,;5.79,-1.29,;7.07,-3.76,;8.32,-4.66,;6.17,-5,;7.98,-2.51,;2.39,1.13,;1.05,.36,)|
O[C@H]1CCCC[C@H](C1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r|
OC[C@@H]1CC[C@H](CO1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r|
O[C@H]1CCCC(CC1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r|
FC(F)(F)c1cccc(c1)-c1cnc2ccc(NC3CC4(C3)CCNC4)nn12 |(8.35,-3.07,;6.84,-2.75,;6.52,-4.26,;7.16,-1.25,;5.34,-2.43,;4.25,-3.56,;2.75,-3.24,;2.27,-1.78,;3.3,-.63,;4.81,-.96,;2.83,.83,;3.73,2.08,;2.83,3.32,;1.36,2.85,;.03,3.62,;-1.31,2.85,;-1.31,1.31,;-2.64,.54,;-3.97,1.31,;-4.37,2.79,;-5.86,2.39,;-5.46,.91,;-7.27,1.77,;-8.3,2.91,;-7.53,4.25,;-6.02,3.93,;.03,.54,;1.36,1.31,)|
OC[C@H]1CC[C@@H](CO1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r|
CN1CCC2(CC(C2)Nc2ccc3ncc(-c4cccc(c4)C(F)(F)F)n3n2)CC1
CN1CCCC(CC1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1
FC(F)(F)c1ccc(s1)-c1cnc2ccc(NC3CCCNCC3)nn12
OC12CCC(CC1)(CC2)Nc1ccc2ncc(-c3ccc(s3)C(F)(F)F)n2n1
FC(F)(F)c1cccc(c1)-c1cnc2ccc(NC3CC4(C3)CCN(CC4)C3CC3)nn12
FC(F)(F)c1ccc(s1)-c1cnc2ccc(NC3CC4(C3)CCNCC4)nn12
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2nc(C(O)=O)c(-c3cccc(c3)C(F)(F)F)n2n1 |r,wU:7.10,wD:4.3,(-7.47,4.7,;-7.47,3.16,;-8.8,2.39,;-8.8,3.93,;-6.13,2.39,;-6.13,.85,;-4.8,.08,;-3.47,.85,;-3.47,2.39,;-4.8,3.16,;-2.13,.08,;-.8,.85,;-.8,2.39,;.53,3.16,;1.87,2.39,;3.33,2.87,;4.24,1.62,;5.78,1.62,;6.55,.29,;6.55,2.95,;3.33,.38,;3.81,-1.09,;2.78,-2.23,;3.25,-3.7,;4.76,-4.02,;5.84,-2.89,;5.31,-1.41,;7.35,-3.21,;8.86,-3.53,;7.03,-4.71,;7.67,-1.7,;1.87,.85,;.53,.08,)|
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2nc(C#N)c(-c3cccc(c3)C(F)(F)F)n2n1 |r,wU:7.10,wD:4.3,(-8.8,2.39,;-7.47,3.16,;-7.47,4.7,;-8.8,3.93,;-6.13,2.39,;-6.13,.85,;-4.8,.08,;-3.47,.85,;-3.47,2.39,;-4.8,3.16,;-2.13,.08,;-.8,.85,;-.8,2.39,;.53,3.16,;1.87,2.39,;3.33,2.87,;4.24,1.62,;5.78,1.62,;7.32,1.62,;3.33,.38,;3.81,-1.09,;2.78,-2.23,;3.25,-3.7,;4.76,-4.02,;5.84,-2.89,;5.31,-1.41,;7.35,-3.21,;8.86,-3.53,;7.03,-4.71,;7.67,-1.7,;1.87,.85,;.53,.08,)|
O[C@@H]1CCCC[C@H](C1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r|
O[C@@H]1CCC[C@H](CC1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r|
OC[C@@H]1CC[C@H](CO1)Nc1ccc2ncc(-c3ccc(s3)C(F)(F)F)n2n1 |r|
OC[C@H]1CC[C@@H](CO1)Nc1ccc2ncc(-c3ccc(s3)C(F)(F)F)n2n1 |r|
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2ncc(-c3cccc(c3)-c3ccco3)n2n1 |r,wU:7.10,wD:4.3,(-9.29,2.34,;-7.95,3.11,;-7.95,4.65,;-9.29,3.88,;-6.62,2.34,;-6.62,.8,;-5.29,.03,;-3.95,.8,;-3.95,2.34,;-5.29,3.11,;-2.62,.03,;-1.29,.8,;-1.29,2.34,;.05,3.11,;1.38,2.34,;2.85,2.82,;3.75,1.57,;2.85,.33,;3.32,-1.14,;2.29,-2.28,;2.77,-3.75,;4.27,-4.07,;5.3,-2.92,;4.83,-1.46,;6.81,-3.24,;7.44,-4.65,;8.97,-4.49,;9.29,-2.98,;7.95,-2.21,;1.38,.8,;.05,.03,)|
CN(C)c1cccc(c1)-c1cnc2ccc(NCC3CCN(C)CC3)nn12
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2ncc(-c3cccc(c3)S(C)(=O)=O)n2n1 |r,wU:7.10,wD:4.3,(-8.59,2.3,;-7.26,3.07,;-7.26,4.61,;-8.59,3.84,;-5.93,2.3,;-5.93,.76,;-4.59,-.01,;-3.26,.76,;-3.26,2.3,;-4.59,3.07,;-1.93,-.01,;-.59,.76,;-.59,2.3,;.74,3.07,;2.08,2.3,;3.54,2.78,;4.45,1.53,;3.54,.29,;4.02,-1.18,;2.99,-2.32,;3.46,-3.79,;4.97,-4.11,;6,-2.96,;5.52,-1.5,;7.5,-3.28,;8.59,-2.19,;6.73,-4.61,;8.27,-4.61,;2.08,.76,;.74,-.01,)|
CC(C)(O)C1CCC(CC1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |(11.87,5.15,;10.53,4.38,;9.76,5.72,;11.3,3.05,;9.2,3.61,;9.2,2.07,;7.87,1.3,;6.53,2.07,;6.53,3.61,;7.87,4.38,;5.2,1.3,;3.86,2.07,;3.86,3.61,;2.53,4.38,;1.2,3.61,;-.27,4.09,;-1.17,2.84,;-.27,1.6,;-.74,.13,;-2.25,-.19,;-2.73,-1.65,;-1.7,-2.8,;-.19,-2.48,;.29,-1.01,;.84,-3.62,;1.87,-4.77,;-.3,-4.65,;1.99,-2.59,;1.2,2.07,;2.53,1.3,)|
NC(=O)c1cc(Cl)c2c(Cl)c(C3CC3)n([C@H]3CCCNC3)c2n1 |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C3CC3)n([C@@H]3CCCNC3)c2n1 |r|
CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCN(CC1)C1CCNCC1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1Cl |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F |r|
Oc1cccc(Nc2ccnc3[nH]c4ccccc4c23)c1
CCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CN(C)CCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CCN(CC)CCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CN(C)CCCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CCN(CC)CCCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CCN(CC)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CN(C)CCCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CCN(CC)CCCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CN(C)CCN(C)c1cncc(n1)-c1ccc2[nH]cc(-c3ccnc(N)n3)c2c1
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(F)c2)C2CCCCC2)CC1 |r|
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2ccc(F)c(F)c2)C2CCCCC2)CC1 |r|
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2ccnc(F)c2)C2CCCCC2)CC1 |r|
CN1CCN(C[C@@H](NC(=O)C[C@H]2CNC(=O)c3cc(cn23)-c2cccc(Cl)c2)C(C)(C)C)CC1 |r|
C[C@@H](CN1CCN(C)CC1)NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(Cl)c1 |r|
Fc1cccc(CNC(=O)CC2CNC(=O)c3cc(cn23)-c2cccc(c2)C(F)(F)F)c1
FC(F)(F)c1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCC3CCOCC3)n2c1
FC(F)(F)c1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCC3CCCCC3)n2c1
Fc1ccccc1-c1cc2C(=O)NCC(CC(=O)NCC3CCCCC3)n2c1
Fc1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCC3CCCCC3)n2c1
Fc1ccc(cc1F)-c1cc2C(=O)NCC(CC(=O)NCC3CCCCC3)n2c1
Clc1nccc(n1)-c1cc2C(=O)NCC(CC(=O)NCC3CCCCC3)n2c1
Fc1cccc(CNC(=O)CC2CNC(=O)c3cc(cn23)-c2cn[nH]c2)c1
Fc1ccc(cc1F)-c1cc2C(=O)NCC(CC(=O)NCc3ccco3)n2c1
Clc1cccc(c1)-c1cc2C(=O)NCC(CC(=O)NCc3ccco3)n2c1
Fc1ccc(Cl)cc1-c1cc2C(=O)NCC(CC(=O)NCc3ccco3)n2c1
Cc1ccc(Cl)cc1-c1cc2C(=O)NCC(CC(=O)NCc3ccco3)n2c1
NC[C@@H](NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1ccnc(F)c1)c1ccccc1 |r|
NC[C@@H](NC(=O)C[C@@H]1CNC(=O)c2cc(cn12)-c1ccnc(F)c1)c1ccccc1 |r|
NC[C@@H](NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(F)c1)c1ccccc1 |r|
OC[C@@H](NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(F)c1)C1CCCCC1 |r|
OC[C@@H](NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(F)c1)c1ccccc1 |r|
OC[C@H](Cc1ccccc1)NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(F)c1 |r|
NC[C@@H](NC(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(F)c1)C1CCCCC1 |r|
CN1CCN([C@H](C1)c1ccccc1)C(=O)C[C@H]1CNC(=O)c2cc(cn12)-c1cccc(F)c1 |r|
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC
Oc1c2cccc3N=Nc(c23)c2ccccc12 |c:7|
C[C@@]12[C@](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)(CO)O
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC
CN1CCN(CC1)CC(=O)N(C)c2ccc(cc2)N/C(=C\3/c4ccc(cc4NC3=O)C(=O)OC)/c5ccccc5
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cnccc1O[C@H]1CCNC1 |r|
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cnccc1O[C@@H]1CCNC1 |r|
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cnccc1OC1CCNCC1
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cnccc1OC1CCCCC1
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cnccc1OC1CCOCC1
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cnccc1OCC1CCOCC1
O[C@H]1CC[C@@H](CC1)Oc1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r,wU:4.7,wD:1.0,(22.36,-34.59,;21.11,-33.68,;21.28,-32.14,;20.03,-31.23,;18.63,-31.87,;18.46,-33.4,;19.7,-34.3,;17.39,-30.97,;17.55,-29.44,;18.95,-28.81,;19.11,-27.27,;17.85,-26.37,;16.45,-27.01,;16.3,-28.53,;14.9,-29.16,;13.65,-28.26,;13.8,-26.73,;12.24,-28.89,;10.91,-28.13,;9.77,-29.16,;10.4,-30.57,;11.93,-30.4,;9.63,-31.9,;10.41,-33.23,;11.95,-33.23,;9.64,-34.58,;8.09,-34.58,;7.32,-33.24,;8.1,-31.91,;7.33,-30.57,)|
Nc1sc(nc1C(=O)Nc1cnccc1O[C@H]1CCNC1)-c1c(F)cccc1F |r|
Fc1ccccc1-c1cccc(CNc2cnccc2OC2CCNCC2)n1
Fc1cccc(F)c1-c1cccc(CNc2cnccc2OC2CCNCC2)n1
Fc1cccc(F)c1-c1cccc(n1)C(=O)Nc1cnccc1OC1CCNCC1
Fc1cccc(F)c1-c1nc2c(Nc3cnccc3O[C@H]3CCNC3)cccc2s1 |r|
Fc1cccc(F)c1-c1nc(cs1)-c1ccc2nccc(N3CCNCC3)c2c1
NC(=O)c1ccc(cc1)-c1csc(n1)-c1c(F)cccc1F
Fc1cccc(F)c1-c1nc(cs1)C(=O)Nc1cccnc1
NC(=O)c1ccc(cc1)-c1c[nH]c2ncnc(NCCO)c12
Clc1cccc(c1)-c1cnn2ccc(NCC3CCOCC3)nc12
Clc1cccc(c1)-c1cnn2ccc(NCC3CCS(=O)(=O)CC3)nc12
Clc1cccc(c1)-c1cnn2ccc(nc12)N1CCC(=O)CC1
CO[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1 |r,wU:2.1,wD:5.8,(15.02,-50.87,;16.36,-50.1,;17.69,-50.88,;19.03,-50.11,;20.36,-50.88,;20.35,-52.42,;19.03,-53.19,;17.69,-52.42,;21.69,-53.19,;23.02,-52.42,;23.02,-50.88,;24.35,-50.1,;25.68,-50.88,;27.15,-50.4,;28.05,-51.65,;27.15,-52.9,;27.9,-54.23,;27.12,-55.56,;27.87,-56.9,;29.41,-56.91,;30.2,-55.58,;31.74,-55.59,;29.44,-54.24,;25.68,-52.42,;24.35,-53.18,)|
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1 |r,wU:4.3,wD:7.10,(.73,-52.37,;1.51,-51.04,;-.05,-51.03,;1.52,-49.51,;2.84,-51.82,;4.18,-51.06,;5.51,-51.82,;5.5,-53.37,;4.18,-54.14,;2.84,-53.36,;6.84,-54.14,;8.17,-53.37,;8.17,-51.83,;9.5,-51.05,;10.83,-51.83,;12.29,-51.35,;13.2,-52.6,;12.29,-53.84,;13.05,-55.17,;12.26,-56.5,;13.02,-57.84,;14.56,-57.86,;15.34,-56.52,;16.88,-56.53,;14.58,-55.19,;10.83,-53.37,;9.5,-54.13,)|
C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1 |r,wU:1.1,wD:5.8,(53.53,-42.61,;54.31,-43.95,;52.81,-44.35,;55.65,-43.19,;56.98,-43.96,;56.97,-45.5,;55.65,-46.27,;54.31,-45.5,;58.31,-46.27,;59.64,-45.5,;59.64,-43.96,;60.97,-43.18,;62.3,-43.96,;63.76,-43.48,;64.67,-44.73,;63.76,-45.98,;64.52,-47.31,;63.73,-48.63,;64.49,-49.97,;66.03,-49.99,;66.81,-48.65,;68.35,-48.66,;66.05,-47.32,;62.3,-45.5,;60.97,-46.26,)|
O[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1 |r,wU:1.0,wD:4.7,(34.05,-42.38,;35.38,-43.15,;36.72,-42.39,;38.04,-43.16,;38.04,-44.7,;36.71,-45.47,;35.38,-44.69,;39.38,-45.47,;40.71,-44.7,;40.71,-43.16,;42.04,-42.38,;43.37,-43.16,;44.83,-42.68,;45.74,-43.93,;44.83,-45.18,;45.59,-46.51,;44.8,-47.83,;45.56,-49.17,;47.1,-49.19,;47.88,-47.85,;49.42,-47.86,;47.12,-46.52,;43.37,-44.7,;42.04,-45.46,)|
N[C@H]1CCCN(C1)c1ccn2ncc(-c3cccc(Cl)c3)c2n1 |r|
N[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(Cl)c3)c2n1 |r,wU:1.0,wD:4.7,(2.13,-40.45,;3.47,-41.22,;4.8,-40.46,;6.13,-41.22,;6.13,-42.77,;4.8,-43.54,;3.46,-42.76,;7.46,-43.54,;8.79,-42.77,;8.79,-41.23,;10.12,-40.45,;11.45,-41.23,;12.92,-40.75,;13.82,-42,;12.92,-43.24,;13.67,-44.57,;12.89,-45.9,;13.64,-47.24,;15.18,-47.26,;15.97,-45.92,;17.51,-45.93,;15.21,-44.59,;11.45,-42.77,;10.12,-43.53,)|
FC(F)(F)c1cccc(c1)-c1cnn2ccc(NCC3CCS(=O)(=O)CC3)nc12
FC(F)(F)c1cccc(c1)-c1cnn2ccc(NCC3CCOCC3)nc12
CO[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(c3)C(F)(F)F)c2n1 |r,wU:2.1,wD:5.8,(1.09,-33.12,;2.42,-32.35,;3.75,-33.13,;5.09,-32.36,;6.42,-33.13,;6.42,-34.68,;5.09,-35.45,;3.75,-34.67,;7.75,-35.44,;9.08,-34.67,;9.08,-33.13,;10.41,-32.35,;11.74,-33.13,;13.21,-32.66,;14.12,-33.9,;13.21,-35.15,;13.96,-36.48,;13.18,-37.81,;13.93,-39.15,;15.48,-39.16,;16.26,-37.83,;15.5,-36.49,;17.8,-37.84,;18.56,-39.18,;18.58,-36.51,;19.33,-37.84,;11.74,-34.67,;10.41,-35.43,)|
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(c3)C(F)(F)F)c2n1 |r,wU:4.3,wD:7.10,(51,-26.01,;51.77,-24.69,;50.23,-24.68,;51.78,-23.15,;53.11,-25.47,;54.44,-24.7,;55.77,-25.47,;55.77,-27.01,;54.44,-27.78,;53.11,-27.01,;57.1,-27.78,;58.44,-27.01,;58.44,-25.47,;59.76,-24.69,;61.09,-25.47,;62.56,-24.99,;63.46,-26.24,;62.56,-27.49,;63.31,-28.82,;62.53,-30.15,;63.28,-31.49,;64.82,-31.5,;65.61,-30.17,;64.85,-28.83,;67.15,-30.18,;67.91,-31.51,;67.92,-28.85,;68.68,-30.17,;61.09,-27.01,;59.76,-27.77,)|
C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(c3)C(F)(F)F)c2n1 |r,wU:1.1,wD:5.8,(32.77,-22.86,;33.55,-24.2,;32.05,-24.6,;34.89,-23.44,;36.21,-24.2,;36.21,-25.75,;34.89,-26.52,;33.55,-25.74,;37.55,-26.52,;38.88,-25.75,;38.88,-24.21,;40.21,-23.43,;41.54,-24.21,;43,-23.73,;43.91,-24.98,;43,-26.22,;43.76,-27.56,;42.97,-28.88,;43.73,-30.22,;45.27,-30.24,;46.05,-28.9,;45.29,-27.57,;47.59,-28.91,;48.35,-30.25,;48.37,-27.58,;49.13,-28.91,;41.54,-25.75,;40.21,-26.51,)|
O[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(c3)C(F)(F)F)c2n1 |r,wU:1.0,wD:4.7,(12.63,-23.03,;13.97,-23.8,;15.3,-23.04,;16.63,-23.8,;16.63,-25.35,;15.3,-26.12,;13.97,-25.34,;17.96,-26.12,;19.3,-25.35,;19.3,-23.81,;20.63,-23.03,;21.95,-23.81,;23.42,-23.33,;24.33,-24.58,;23.42,-25.83,;24.18,-27.16,;23.39,-28.48,;24.15,-29.82,;25.69,-29.84,;26.47,-28.5,;25.71,-27.17,;28.01,-28.51,;28.77,-29.85,;28.79,-27.18,;29.55,-28.51,;21.95,-25.35,;20.63,-26.11,)|
FC(F)(F)Oc1cccc(c1)-c1cnn2ccc(NCC3CCS(=O)(=O)CC3)nc12
FC(F)(F)Oc1cccc(c1)-c1cnn2ccc(NCC3CCOCC3)nc12
CO[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wU:2.1,wD:5.8,(37.44,-13.65,;38.78,-12.89,;40.11,-13.66,;41.44,-12.9,;42.77,-13.66,;42.77,-15.21,;41.44,-15.98,;40.11,-15.2,;44.1,-15.98,;45.44,-15.21,;45.44,-13.67,;46.77,-12.89,;48.09,-13.67,;49.56,-13.19,;50.47,-14.44,;49.56,-15.68,;50.32,-17.02,;49.53,-18.34,;50.29,-19.68,;51.83,-19.7,;52.61,-18.36,;54.15,-18.37,;54.91,-19.71,;56.45,-19.72,;54.13,-21.04,;55.59,-21.08,;51.85,-17.03,;48.09,-15.21,;46.77,-15.97,)|
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wU:4.3,wD:7.10,(20.54,-14.89,;21.32,-13.57,;19.78,-13.56,;21.32,-12.03,;22.65,-14.35,;23.99,-13.58,;25.31,-14.35,;25.31,-15.89,;23.98,-16.66,;22.65,-15.89,;26.65,-16.66,;27.98,-15.89,;27.98,-14.35,;29.31,-13.57,;30.63,-14.35,;32.1,-13.87,;33.01,-15.12,;32.1,-16.37,;32.86,-17.7,;32.07,-19.02,;32.82,-20.36,;34.37,-20.38,;35.15,-19.04,;36.69,-19.05,;37.45,-20.39,;38.99,-20.4,;36.67,-21.72,;38.13,-21.77,;34.39,-17.71,;30.63,-15.89,;29.31,-16.65,)|
C[C@]1(O)CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wU:1.1,wD:5.8,(2.94,-11.92,;3.72,-13.26,;2.22,-13.65,;5.06,-12.49,;6.38,-13.26,;6.38,-14.81,;5.06,-15.57,;3.72,-14.8,;7.72,-15.57,;9.05,-14.8,;9.05,-13.26,;10.38,-12.49,;11.71,-13.26,;13.17,-12.79,;14.08,-14.03,;13.17,-15.28,;13.93,-16.61,;13.14,-17.94,;13.9,-19.28,;15.44,-19.29,;16.22,-17.96,;17.76,-17.97,;18.52,-19.3,;20.06,-19.31,;17.74,-20.63,;19.2,-20.68,;15.46,-16.62,;11.71,-14.8,;10.38,-15.56,)|
O[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wU:1.0,wD:4.7,(50.22,-3.1,;51.55,-3.88,;52.88,-3.11,;54.21,-3.88,;54.21,-5.42,;52.88,-6.19,;51.55,-5.42,;55.54,-6.19,;56.88,-5.42,;56.88,-3.88,;58.21,-3.1,;59.54,-3.88,;61,-3.4,;61.91,-4.65,;61,-5.9,;61.76,-7.23,;60.97,-8.56,;61.73,-9.9,;63.27,-9.91,;64.05,-8.58,;65.59,-8.59,;66.35,-9.93,;67.89,-9.94,;65.57,-11.25,;67.03,-11.3,;63.29,-7.24,;59.54,-5.42,;58.21,-6.18,)|
N[C@H]1CCCN(C1)c1ccn2ncc(-c3cccc(OC(F)(F)F)c3)c2n1 |r|
N[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wU:1.0,wD:4.7,(16.04,-2.27,;17.37,-3.04,;18.71,-2.28,;20.04,-3.05,;20.04,-4.59,;18.71,-5.36,;17.37,-4.59,;21.37,-5.36,;22.7,-4.59,;22.7,-3.05,;24.03,-2.27,;25.36,-3.05,;26.83,-2.57,;27.73,-3.82,;26.83,-5.07,;27.58,-6.4,;26.8,-7.73,;27.55,-9.07,;29.09,-9.08,;29.88,-7.75,;31.42,-7.76,;32.18,-9.09,;33.72,-9.1,;31.4,-10.42,;32.86,-10.47,;29.12,-6.41,;25.36,-4.59,;24.03,-5.35,)|
CN1CCC(CNc2ccn3ncc(-c4cccc(OC(F)(F)F)c4)c3n2)CC1
Fc1cccnc1-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
C1CC11CCNC[C@@H]1Oc1cncc(n1)-c1n[nH]c2ccc(cc12)-c1ccccc1 |r|
Fc1ccccc1-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(O[C@@H]4CNCCC44CC4)n3)c2c1 |r|
c1cc(c(c(c1)F)c2ccc3c(c2)c(n[nH]3)c4cncc(n4)O[C@H]5CNCCC56CC6)F
CC1(C)CCNCC1Oc1cncc(n1)-c1n[nH]c2ccc(cc12)-c1c(F)cccc1F
c1cc(c(c(c1)F)c2ccc3c(c2)c(n[nH]3)c4cncc(n4)O[C@H]5CNCCC56CC6)F
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(OC4CNCCC4=C)n3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(OC4CCCNC4)n3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(OC4CCNCC4)n3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(NC4CNC4)n3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(NC4CCNC4)n3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(NC4CCCNC4)n3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(NC4CCNCC4)n3)c2c1
OC1CCN(CC1)c1cncc(n1)-c1n[nH]c2ccc(cc12)-c1c(F)cccc1F
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(n3)N3CCNCC3)c2c1
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(n3)N3CCCNCC3)c2c1
NC1CCN(C1)c1cncc(n1)-c1n[nH]c2ccc(cc12)-c1c(F)cccc1F
NC1CCN(CC1)c1cncc(n1)-c1n[nH]c2ccc(cc12)-c1c(F)cccc1F
Fc1ccncc1-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
Fc1cnccc1-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
Fc1ncccc1-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
Cn1cncc1-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
C1CC11CCNC[C@@H]1Oc1cncc(n1)-c1n[nH]c2ccc(cc12)-c1nccs1 |r|
Nc1ccc(c(F)c1)-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
Oc1ccc(c(F)c1)-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
NC(=O)c1ccc(c(F)c1)-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
CS(=O)(=O)c1ccc(c(F)c1)-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
CS(=O)(=O)Nc1ccc(c(F)c1)-c1ccc2[nH]nc(-c3cncc(O[C@H]4CNCCC44CC4)n3)c2c1 |r|
Fc1cccc(F)c1-c1ccc2[nH]nc(-c3cncc(n3)N3CCCCC3)c2c1
NC1CCCN(C1)c1cncc(n1)-c1n[nH]c2ccc(cc12)-c1c(F)cccc1F
Nc1nnc(s1)-c1ccc2[nH]cc(-c3cncc(n3)N3CCCC3)c2c1
Nc1ncc(s1)-c1ccc2[nH]nc(-c3cnc4ccccc4c3)c2c1
CSc1nnc(s1)-c1ccc2[nH]cc(-c3cnc4ccccc4c3)c2c1
CC(C)Oc1cnc(cn1)-c1c[nH]c2ccc(cc12)-c1nnc(N)s1
CCN(CC)CCNC(=O)c1c(C)[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c1C
c1c(cc(c2c1CN(C2=O)C3CCN(CC3)C4CCC(CC4)(F)F)C(=O)N)F
c1n[nH]c2cnc(cc12)-c1cccnc1
O=C(Nc1cn[nH]c1)c1cccnc1
Cc1n[nH]c2cnc(cc12)-c1cccnc1
Cc1c[nH]c2cnc(cc12)-c1cccnc1
Cc1n[nH]c2cnc(cc12)-c1cn[nH]c1
Cc1n[nH]c2ccc(cc12)-c1cn[nH]c1
c1ccc(cc1)-c1n[nH]c2cnc(cc12)-c1cccnc1
c1ccc(nc1)-c1n[nH]c2cnc(cc12)-c1cccnc1
Cc1n[nH]c2cnc(cc12)-c1cnccc1N1CCC[C@H](N)C1 |r|
N[C@H]1CCCN(C1)c1ccncc1-c1cc2c(n[nH]c2cn1)-c1ccccc1F |r|
Fc1ccccc1-c1n[nH]c2cnc(cc12)-c1cnccc1O[C@@H]1CCCNC1 |r|
Cc1n[nH]c2cnc(cc12)-c1cncc(n1)N1CCC(N)CC1
NC1CCN(CC1)c1cncc(n1)-c1cc2c(n[nH]c2cn1)-c1ccccc1F
NCCNc1cccc(n1)-c1n[nH]c2cnc(cc12)-c1cccnc1
C1CN(CCN1)c1cccc(n1)-c1n[nH]c2cnc(cc12)-c1cccnc1
Cc1cncc(c1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
Cc1cncc(n1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
CCn1cncc(-c2cc3c(n[nH]c3cn2)-c2cccc(n2)N2CCNCC2)c1=O
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
N#CCn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
C(C1CC1)n1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
C1CN(CCN1)c1cccc(n1)-c1n[nH]c2cnc(cc12)-n1ccnc1
NC(=O)Cc1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
NC(=O)Nc1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
CN1C(=O)CN(C1=O)c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
C1COC(C1)c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
C1COCC(C1)c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
O=C1CN(CCN1)c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
C1CN(CCN1)c1cccc(n1)-c1n[nH]c2cnc(cc12)N1CCOCC1
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1ccccn1
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCCNCC1
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)C1CCNCC1
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(O[C@@H]2CCCNC2)n1 |r|
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCC[C@@H](N)C1 |r|
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CC[C@@H](N)C1 |r|
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
Cn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(c1)N1CCC[C@@H](N)C1 |r|
Cc1ccc(nc1N1CCC[C@H](N)C1)-c1n[nH]c2cnc(cc12)-c1cnn(C)c1 |r|
CCn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCNCC1
Oc1cccc(c1)-c1ccc2c(NC(=O)C3CC3)n[nH]c2n1
Cn1c2nc(Nc3ccc4[nH]ccc4c3)ncc2cc(c1=O)S(=O)(=O)c1ccc(F)cc1F
C[C@@H]1C[C@H]1C(=O)N1CCN(C[C@H]1C)c1cnc(C#N)c(n1)-c1cnn(C)c1 |r|
Cc1cc(cc(N)n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F
Nc1nccc(n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
Nc1cc(ncn1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
Cc1nc(N)cc(n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
Nc1cc(nc(N)n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F
COc1cc(cc(N)n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
Cc1cc(cc(N)n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
Cc1cc(nc(N)n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1nccs1
Nc1cc(nc(n1)C(F)(F)F)-c1ccncc1NC(=O)c1nc(ccc1N)-c1nccs1
Nc1cc(nc(n1)C(F)(F)F)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
CC(=O)Nc1nc(cs1)C(=O)Nc2ccccc2N3CCCCC3
Cc1cc(nc(N)n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F
Nc1cc(ccn1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F
Nc1ccc(nc1C(=O)Nc1cnccc1-c1ccncc1)-c1ccccc1F
Nc1cc(ccn1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F
Nc1cncc(n1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F
Nc1ccc(nc1C(=O)Nc1cnccc1-c1cccnc1N)-c1c(F)cccc1F
Nc1ccc(cn1)-c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1F
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC\C=C\C2)nc13 |r,t:24|
[H][C@@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC\C=C\C2)nc13 |r,t:24|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC\C=C/C2)nc13 |r,c:24|
[H][C@@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC\C=C/C2)nc13 |r,c:24|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NCCCC2)nc13 |r|
[H][C@@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NCCCC2)nc13 |r|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(N[C@H](C)\C=C\C2)nc13 |r,t:25|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(N[C@@H](C)\C=C\C2)nc13 |r,t:25|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC\C(C)=C\C2)nc13 |r,t:25|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(N[C@H](C)\C=C/C2)nc13 |r,c:25|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC\C(C)=C/C2)nc13 |r,c:25|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(N[C@H](C)CCC2)nc13 |r|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(N[C@@H](C)CCC2)nc13 |r|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC[C@@H](C)CC2)nc13 |r|
[H][C@]12CNC(=O)c3cc([nH]c13)-c1cccc3nc(C)c(NC[C@H](C)CC2)nc13 |r|
c1n[nH]c2c1c1c3ccccc3[nH]c1c1[nH]c3ccccc3c21
N[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1c(F)cccc1F |r|
N[C@H]1CN(C[C@@H](N)[C@@H]1O)c1ccncc1Nc1ncc2ccc(nn12)-c1ncccc1F |r|
N[C@H]1CCCN(C1)c1ccnc(NC(=O)c2c[nH]c3ccc(nc23)-c2ccccc2F)c1 |r|
NCCn1cc(-c2cc(-c3cc4ccccc4s3)c3[nH]ncc3c2)c2nc(N)ncc12
Cn1nc(C(N)=O)c2CCc3cnc(NC4CCN(CC4)C(=O)c4ccccc4)nc3-c12
CNC(=O)c1nn(C)c-2c1CCc1cnc(NC3CCN(CC3)C(=O)C3CCN(CC3)S(C)(=O)=O)nc-21
CC(=O)N1CCC(CC1)Nc1ncc2CCc3c(nn(C)c3-c2n1)C(N)=O
O=C(Cc1ccccc1)Nc1cccc(c1)-c1nc2sccn2c1-c1ccnc(Nc2cccc(c2)N2CCOCC2)n1
CC(C)(C)c1cc(NC(=O)Nc2ccc(cc2)-c2cn3c(n2)sc2cc(OCCN4CCOCC4)ccc32)no1
COc1cc2c(ncnc2cc1OCCCN1CCCCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
CNC(=O)c1cc(ccn1)Oc2ccc(cc2)NC(=O)Nc3ccc(c(c3)C(F)(F)F)Cl
CO[C@@H]1[C@@H](C[C@H]2O[C@]1(C)n1c3ccccc3c3c4[C@H](O)NC(=O)c4c4c5ccccc5n2c4c13)N(C)C(=O)c1ccccc1 |r|
Brc1cccc2[nH]c3c(ccc4c(C=O)c[nH]c34)c12
CN1CCN(CC1)c1ccc(OC(F)(F)F)c(Nc2ncc3CCc4c(nn(CCO)c4-c3n2)C(N)=O)c1
OC(=O)c1cc2cc(ccc2o1)C(F)(F)F
OC(=O)c1cc2cc(ccc2o1)-c1cccnc1
OC(=O)c1cc2cc(ccc2o1)-c1cnccn1
Cn1cc(cn1)-c1ccc2oc(cc2c1)C(O)=O
OC(=O)c1cc2cc(ccc2o1)-c1cncc(NCC2CCNCC2)n1
OC(=O)c1cc2cc(ccc2o1)-c1cnn(c1)C1CCNCC1
NCCCCNc1ccnc(n1)-c1ccc2oc(cc2c1)C(O)=O
NCCCCNc1nccc(n1)-c1ccc2oc(cc2c1)C(O)=O
N[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O |r,wU:4.7,wD:1.0,(18.96,-16.61,;20.29,-17.38,;20.29,-18.92,;21.63,-19.69,;22.95,-18.91,;22.95,-17.38,;21.62,-16.61,;24.29,-19.68,;25.62,-18.9,;25.61,-17.36,;26.94,-16.59,;28.28,-17.36,;28.27,-18.9,;26.95,-19.66,;29.6,-19.66,;29.6,-21.21,;30.93,-21.98,;32.27,-21.2,;33.74,-21.67,;34.64,-20.41,;33.72,-19.17,;32.26,-19.66,;30.93,-18.89,;36.18,-20.41,;36.95,-21.73,;36.94,-19.07,)|
N[C@H]1CC[C@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O |r,wD:4.7,1.0,(37.06,-16.23,;38.39,-17,;38.39,-18.54,;39.73,-19.31,;41.06,-18.53,;41.05,-16.99,;39.73,-16.23,;42.39,-19.29,;43.72,-18.52,;43.71,-16.97,;45.05,-16.2,;46.38,-16.97,;46.38,-18.51,;45.05,-19.28,;47.71,-19.28,;47.7,-20.82,;49.04,-21.59,;50.38,-20.81,;51.84,-21.28,;52.74,-20.03,;51.83,-18.79,;50.37,-19.27,;49.03,-18.51,;54.28,-20.02,;55.06,-21.35,;55.04,-18.68,)|
OC(=O)c1cc2cc(ccc2o1)-c1cncc(NC2CCNCC2)n1
NC[C@H]1CC[C@@H](CC1)Nc1cncc(n1)-c1ccc2oc(cc2c1)C(O)=O |r,wU:5.8,wD:2.1,(-10.87,-26.04,;-9.53,-25.27,;-8.19,-26.04,;-8.19,-27.58,;-6.85,-28.36,;-5.52,-27.57,;-5.53,-26.04,;-6.86,-25.28,;-4.19,-28.34,;-2.86,-27.56,;-2.86,-26.02,;-1.53,-25.25,;-.2,-26.02,;-.2,-27.56,;-1.53,-28.33,;1.13,-28.32,;1.13,-29.87,;2.46,-30.64,;3.8,-29.86,;5.26,-30.33,;6.16,-29.08,;5.25,-27.83,;3.79,-28.32,;2.46,-27.56,;7.7,-29.07,;8.48,-30.39,;8.46,-27.73,)|
OC(=O)c1cc2cc(ccc2o1)-c1cncc(NC2CNC2)n1
OC(=O)c1cc2cc(Br)cc(OCC3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(OCc3ccncc3)c2o1
OC(=O)c1cc2cc(Br)cc(OCC3CCCNC3)c2o1
OC(=O)c1cc2cc(Br)cc(NCC3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(OCCC3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(OCCc3ccncc3)c2o1
OC(=O)c1cc2cc(Br)cc(NCCC3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(NC(=O)C3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(NC(=O)CC3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(OCC(=O)N3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(C(=O)NC3CCNCC3)c2o1
OC(=O)c1cc2cc(Br)cc(C(=O)NCC3CCNCC3)c2o1
N[C@H]1CC[C@H](CC1)Nc1cc(Br)cc2cc(oc12)C(O)=O |r,wU:4.7,1.0,(33.37,-17.22,;34.71,-16.45,;34.71,-14.91,;36.04,-14.15,;37.36,-14.92,;37.38,-16.46,;36.04,-17.22,;38.7,-14.15,;38.69,-12.61,;37.36,-11.84,;37.36,-10.3,;36.03,-9.53,;38.69,-9.53,;40.02,-10.29,;41.49,-9.81,;42.4,-11.05,;41.5,-12.3,;40.03,-11.83,;43.94,-11.04,;44.72,-12.37,;44.7,-9.7,)|
N[C@H]1CC[C@@H](CC1)Nc1cc(Br)cc2cc(oc12)C(O)=O |r,wU:1.0,wD:4.7,(48.98,-16.4,;50.31,-15.63,;50.32,-14.09,;51.64,-13.33,;52.97,-14.1,;52.98,-15.64,;51.64,-16.4,;54.3,-13.33,;54.3,-11.79,;52.96,-11.02,;52.97,-9.48,;51.63,-8.71,;54.29,-8.71,;55.63,-9.47,;57.09,-8.99,;58,-10.23,;57.1,-11.48,;55.64,-11.01,;59.54,-10.22,;60.32,-11.55,;60.3,-8.88,)|
O[C@H]1CC[C@H](CC1)Nc1cc(Br)cc2cc(oc12)C(O)=O |r,wU:4.7,1.0,(-2.19,-27.26,;-.86,-26.5,;-.85,-24.96,;.47,-24.19,;1.8,-24.97,;1.81,-26.5,;.47,-27.27,;3.13,-24.2,;3.13,-22.66,;1.8,-21.89,;1.8,-20.34,;.46,-19.58,;3.12,-19.57,;4.46,-20.34,;5.92,-19.85,;6.83,-21.09,;5.93,-22.35,;4.47,-21.88,;8.37,-21.09,;9.15,-22.41,;9.14,-19.75,)|
O[C@H]1CC[C@@H](CC1)Nc1cc(Br)cc2cc(oc12)C(O)=O |r,wU:1.0,wD:4.7,(15.29,-27.62,;16.63,-26.85,;16.63,-25.31,;17.96,-24.55,;19.28,-25.32,;19.3,-26.86,;17.96,-27.63,;20.62,-24.55,;20.61,-23.01,;19.28,-22.24,;19.28,-20.7,;17.95,-19.93,;20.61,-19.93,;21.94,-20.69,;23.41,-20.21,;24.32,-21.45,;23.42,-22.7,;21.95,-22.24,;25.86,-21.44,;26.64,-22.77,;26.62,-20.11,)|
CCN1CCN(CC1)c2ccc(cc2)Nc3cc(ncn3)N(C)C(=O)Nc4c(c(cc(c4Cl)OC)OC)Cl
CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)OCCN4CCCC4
CC1(CNc2c1ccc(c2)NC(=O)c3cccnc3NCc4ccncc4)C
Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Oc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(F)cc23)c(C)c1C(=O)NC[C@H](O)CN1CCOCC1
COCCOc1cc2c(cc1OCCOC)ncnc2Nc3cccc(c3)C#C
CN1c2c(cnc(n2)Nc3cccc(c3)SC)C=C(C1=O)c4c(cccc4Cl)Cl
CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
C[C@@H](Oc1cc(cnc1N)-c1cnn(c1)C1CCNCC1)c1c(Cl)ccc(F)c1Cl |r|
C[C@@H]1CCN(C[C@@H]1N(C)c1ncnc2[nH]ccc12)C(=O)CC#N |r|
Cc1ccc(cc1Nc2nc(cs2)c3cccnc3)NC(=O)c4ccc(cc4)CN5CCN(CC5)C
CCN(CCCOc1ccc2c(c1)ncnc2Nc3cc(n[nH]3)CC(=O)Nc4cccc(c4)F)CCO
CC[C@H]1N(C2CCCC2)c2nc(Nc3ccc(cc3OC)C(=O)NC3CCN(C)CC3)ncc2N(C)C1=O |r|
Cn1cc(C2=C(C(=O)NC2=O)c2cn(C3CCN(Cc4ccccn4)CC3)c3ccccc23)c2ccccc12 |t:4|
Nc1nc(N)c2nc(-c3cccc(O)c3)c(nc2n1)-c1cccc(O)c1
OC(=O)c1ccc(Nc2ncc3CN=C(c4cc(Cl)ccc4-c3n2)c2c(F)cccc2F)cc1 |c:13|
Cn1cc(cn1)-c1ccc2nnc(Sc3ccc4ncccc4c3)n2n1
C[C@@H](O)COc1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3F)c2c1C
CN(C)C/C=C/C(=O)Nc1cc2c(cc1O[C@H]3CCOC3)ncnc2Nc4ccc(c(c4)Cl)F
CN1CCN(CC1)c1ccc2nc([nH]c2c1)-c1c(N)c2c(F)cccc2[nH]c1=O
c1cc(c(c(c1)Cl)C2=C3C=CC(=NN3C=NC2=O)Sc4ccc(cc4F)F)Cl
Cc1cccc(c1NC(=O)c2cnc(s2)Nc3cc(nc(n3)C)N4CCN(CC4)CCO)Cl
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
COc1c(Cl)cc2c3ccncc3[nH]c2c1NC(=O)c1cccnc1C
Cn1c(Nc2ccc(cc2)C(F)(F)F)nc2cc(Oc3ccnc(c3)-c3ncc([nH]3)C(F)(F)F)ccc12
CN(C)CC(=O)N1CCC(CC1)c1ccc(NC(=O)c2ncc([nH]2)C#N)c(c1)C1=CCCCC1 |t:31|
Cc1[nH]c(\C=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)Cc2c(Cl)cccc2Cl)c(C)c1C(=O)N1CCC[C@@H]1CN1CCCC1 |r|
CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccn4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
CNC(=O)c1ccccc1Sc2ccc3c(c2)[nH]nc3/C=C/c4ccccn4
OCCn1cc(c(n1)-c1ccncc1)-c1ccc2C(CCc2c1)N=O
O=C(N1CCNCC1)c1ccc(\C=C\c2n[nH]c3ccccc23)cc1
CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl
c1c[nH]c2c1c(ncn2)c3cnn(c3)[C@H](CC#N)C4CCCC4
Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)-c2cccc3[nH]nc(N)c23)c1
COc1cc2c(cc1OCCCN3CCOCC3)c(ncn2)Nc4ccc(c(c4)Cl)F
CS(=O)(=O)N1CCN(Cc2cc3nc(nc(N4CCOCC4)c3s2)-c2cccc3[nH]ncc23)CC1
CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC
Cn1cnc2c1cc(c(c2F)Nc3ccc(cc3Cl)Br)C(=O)NOCCO
COc1cc2c(Oc3ccc(NC(=O)C4(CC4)C(=O)NC4=CCC(F)C=C4)cc3F)ccnc2cc1OCCCN1CCOCC1 |c:26,t:21|
C[C@@H](Oc1cc(sc1C(N)=O)-n1cnc2ccc(CN3CCN(C)CC3)cc12)c1ccccc1C(F)(F)F |r|
CS(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Clc1cccc(Cl)c1C(=O)Nc1cn[nH]c1C(=O)NC1CCNCC1
CCn1c(nc2c(ncc(OC[C@H]3CCCNC3)c12)C#CC(C)(C)O)-c1nonc1N |r|
COc1ccc(cc1)COc2ccc(cc2OC)Cc3cnc(nc3N)N
C=CC(=O)Nc1cc2c(cc1OCCCN3CCOCC3)ncnc2Nc4ccc(c(c4)Cl)F
CC(C)(C)c1cnc(o1)CSc2cnc(s2)NC(=O)C3CCNCC3
COc1cc(Oc2ccnc3cc(OC)c(OC)cc23)ccc1NC(=O)NC(C)c1nccs1
Cc1ccc2c(\C=C3/Oc4c(ccc(O)c4CN4CCNCC4)C3=O)c[nH]c2n1
Oc1ccc2C(=O)\C(Oc2c1CN1CCNCC1)=C\c1c[nH]c2ncccc12
COc1ccc2C(=O)\C(Oc2c1CN1CCNCC1)=C\c1c[nH]c2nc(Cl)ccc12
COc1ccc2C(=O)\C(Oc2c1CN1CCNCC1)=C\c1c[nH]c2nc(C)ccc12
COc1ccc2C(=O)C(Oc2c1CN1CCNCC1)=Cc1c[nH]c2ncccc12 |w:19.22|
Oc1ccc2C(=O)\C(Oc2c1CN1CCNCC1)=C\c1c[nH]c2nc(Cl)ccc12
CCc1ccc2c(\C=C3/Oc4c(ccc(OC)c4CN4CCNCC4)C3=O)c[nH]c2n1
CC(C)n1nc(-c2cc3cc(O)ccc3[nH]2)c2c(N)ncnc12
COc1cc2c(Oc3ccc4[nH]c(C)cc4c3F)ncnc2cc1OCCCN1CCCC1
Fc1ccc(C(=O)NOCC2CC2)c(Nc2ccc(I)cc2Cl)c1F
CNC(=O)c1c(F)cccc1Nc1nc(Nc2cc3N(CCc3cc2OC)C(=O)CN(C)C)nc2[nH]ccc12
Cc1n[nH]c2ccc(cc12)-c1cncc(OC[C@@H](N)Cc2ccccc2)c1 |r|
CN1CCC(CC1)COc2cc3c(cc2OC)c(ncn3)Nc4ccc(cc4F)Br
Cc1cnc2c(NCCN)nc3ccc(C)cc3n12
CCN1CCN(Cc2ccc(NC(=O)Nc3ccc(Oc4cc(NC)ncn4)cc3)cc2C(F)(F)F)CC1
CN1CC[C@@H]([C@H](O)C1)c1c(O)cc(O)c2c1oc(cc2=O)-c1ccccc1Cl |r|
Clc1ccc(Nc2nnc(Cc3ccncc3)c3ccccc23)cc1
COc1ccc(c(c1C(=O)c2cnc(nc2N)NC3CCN(CC3)S(=O)(=O)C)F)F
CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F
CN(c1ccc2c(C)n(C)nc2c1)c1ccnc(Nc2ccc(C)c(c2)S(N)(=O)=O)n1
Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1ccc(OCCN2CCOCC2)c2ccccc12)C(C)(C)C
CN1CCN(CC1)c1cc(Nc2cc(C)n[nH]2)nc(Sc2ccc(NC(=O)C3CC3)cc2)n1
Oc1ccc(cc1)-c1ccc2c(n[nH]c2n1)-c1ccc(cc1)N1CCNCC1
Oc1ccc(cc1)-c1ccc2c(c[nH]c2n1)-c1ccc(cc1)N1CCNCC1
Oc1ccc(cc1)-c1ccc2c(c[nH]c2c1)-c1ccc(cc1)N1CCNCC1
C1CN(CCN1)c1ccc(cc1)-c1n[nH]c2nc(ccc12)-c1ccccc1
COc1ccc(cc1)-c1ccc2c(n[nH]c2n1)-c1ccc(cc1)N1CCNCC1
C1CN(CCN1)c1ccc(cc1)-c1n[nH]c2nc(ccc12)-c1ccncc1
Nc1ccc(cn1)-c1ccc2c(n[nH]c2n1)-c1ccc(cc1)N1CCNCC1
Nc1cc(ccn1)-c1ccc2c(n[nH]c2n1)-c1ccc(cc1)N1CCNCC1
NS(=O)(=O)c1ccc(cc1)-c1ccc2c(n[nH]c2n1)-c1ccc(cc1)N1CCNCC1
C1CN(CCN1)c1ccc(cc1)-c1n[nH]c2nc(ccc12)-c1cccc2[nH]ccc12
C1CN(CCN1)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1cncnc1
C1CN(CCN1)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1cccnc1
C1CN(CCN1)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1ccncc1
C1CN(CCN1)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1ccccn1
C1CN(CCN1)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1cnccn1
Nc1ccc(-c2c[nH]c3ccc(cc23)-c2cnccn2)c(F)n1
N[C@H]1CC[C@@H](CC1)Oc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1 |r,wU:4.7,wD:1.0,(12.09,-39.09,;10.76,-39.85,;9.43,-39.08,;8.08,-39.85,;8.1,-41.38,;9.42,-42.16,;10.75,-41.39,;6.76,-42.15,;6.76,-43.69,;5.43,-44.46,;5.43,-46.01,;6.76,-46.77,;8.09,-46,;8.09,-44.46,;9.42,-46.77,;9.42,-48.32,;10.75,-49.09,;12.09,-48.31,;13.56,-48.78,;14.46,-47.52,;13.55,-46.28,;14.02,-44.82,;12.98,-43.69,;13.44,-42.23,;14.95,-41.89,;15.42,-40.42,;15.99,-43.03,;15.52,-44.49,;16.56,-45.63,;12.08,-46.77,;10.75,-46,)|
Nc1ccc(-c2c[nH]c3ccc(cc23)-c2cncc(n2)N2CCNCC2)c(F)n1
NC1CCCN(C1)c1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1
C[C@H](N)COc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1 |r|
CC[C@H](N)COc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1 |r|
CC(C)[C@H](N)COc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1 |r|
CC(C)(C)[C@H](N)COc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1 |r|
N[C@H](COc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1)c1ccccc1 |r|
N[C@@H](COc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)nc3F)c2c1)c1ccccc1 |r|
c1cc(cc(c1)Cl)Nc2c3ccncc3c4ccc(cc4n2)C(=O)O
COC(=O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc21
NC(=O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc21
Clc1cccc(Nc2nc3ccccc3c3cnccc23)c1
OC(=O)c1ccc2nc(Nc3cccc(Cl)c3)c3ccncc3c2c1
NC(=O)c1ccc2nc(Nc3cccc(Cl)c3)c3ccncc3c2c1
COC(=O)c1cccc2c1nc(Nc1cccc(Cl)c1)c1ccncc21
OC(=O)c1cccc2c1nc(Nc1cccc(Cl)c1)c1ccncc21
NC(=O)c1cccc2c1nc(Nc1cccc(Cl)c1)c1ccncc21
CNC(=O)c1cccc2c1nc(Nc1cccc(Cl)c1)c1ccncc21
CN(C)C(=O)c1cccc2c1nc(Nc1cccc(Cl)c1)c1ccncc21
Clc1cccc(Nc2nc3c(cccc3c3cnccc23)C(=O)NC2CC2)c1
COCCNC(=O)c1cccc2c3cnccc3c(Nc3cccc(Cl)c3)nc12
Clc1cccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c1
Clc1cccc(Nc2nc3c(cccc3c3cnccc23)-c2nnco2)c1
C1CC1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
C1CC(C1)Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
C1CCC(C1)Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
OCCNc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
C1CCN(C1)c1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
N(c1ccccc1)c1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
COc1cccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c1
COc1ccccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Clc1ccccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Fc1ccccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Oc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(Cl)c1
Clc1cc(OCCN2CCOCC2)ccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Fc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(F)c1
Fc1ccc(Cl)cc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
COCCOc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(F)c1
Fc1cc(OCCN2CCCC2)ccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
CNC(=O)c1cccc2c1nc(Nc1ccccc1Cl)c1ccncc21
C#Cc1cccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c1
Clc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)cc1
CN(c1ccccc1Cl)c1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Fc1cccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c1
Fc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)cc1
Cc1ccccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Fc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(Cl)c1
CS(=O)(=O)c1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(Cl)c1
FC(F)(F)Oc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(Cl)c1
CN1CCN(CC1)c1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(Cl)c1
COc1cccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c1Cl
Cc1cc(F)ccc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Cc1ccc(F)cc1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
Fc1cccc(F)c1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
COc1cccc(F)c1Nc1nc2c(cccc2c2cnccc12)-c1nnc[nH]1
CN(C)CCOc1ccc(Nc2nc3c(cccc3c3cnccc23)-c2nnc[nH]2)c(F)c1
NC(=O)c1cccc2c1nc(Nc1ccccc1Cl)c1ccncc21
CNC(=O)c1cccc2c1nc(Nc1cccc(OC)c1Cl)c1ccncc21
CCNC(=O)c1cccc2c1nc(Nc1ccccc1Cl)c1ccncc21
CC(C)NC(=O)c1cccc2c1nc(Nc1ccccc1Cl)c1ccncc21
CC(C)CNC(=O)c1cccc2c3cnccc3c(Nc3ccccc3Cl)nc12
NC(=O)c1cccc2c1nc(Nc1ccccc1F)c1ccncc21
CNC(=O)c1cccc2c1nc(Nc1ccccc1F)c1ccncc21
NC(=O)c1cccc2c1nc(Nc1c(F)cccc1F)c1ccncc21
CNC(=O)c1cccc2c1nc(Nc1c(F)cccc1F)c1ccncc21
CC(C)(C)c1cc(c(s1)NC(=O)Nc2cccc(c2Cl)Cl)C(=O)N3CCC(=O)N(CC3)CCN(C)C
Fc1ccc2[nH]c(cc2c1)C(=O)N1C[C@]2(CCN(C2)C2CCCNC2)c2ccccc12 |r|
Fc1ccc2cc([nH]c2c1)C(=O)N1C[C@]2(CCN(C2)C2CCNC2)c2ccccc12 |r|
C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccccc3[nH]1)c1ccccc21 |r|
C[C@@H]1CCC(CN1)N1CC[C@@]2(C1)CN(C(=O)c1cc3ccc(F)cc3[nH]1)c1ccccc21 |r|
Cn1c2c(C(C#N)C3(CCNCC3)NC2=O)c2ccc(Cl)c(Cl)c12
FC(F)(F)Oc1cccc(c1)-n1nnc2ccc(NCC3CCNCC3)nc12
FC(F)(F)Oc1cccc(c1)-n1nnc2ccc(NC3CCNCC3)nc12
FC(F)(F)Oc1cccc(c1)-n1nnc2ccc(NC3CC4(C3)CCNCC4)nc12
FC(F)(F)Oc1cccc(c1)-n1nnc2ccc(NCC3CC4(C3)CCNCC4)nc12
O[C@H]1CC[C@@H](CC1)Nc1ccc2nnn(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wU:4.7,wD:1.0,(29.89,-28.84,;29.9,-27.3,;31.24,-26.54,;31.24,-24.99,;29.91,-24.22,;28.57,-24.99,;28.57,-26.53,;29.92,-22.68,;31.25,-21.91,;31.25,-20.37,;32.58,-19.6,;33.91,-20.36,;35.39,-19.88,;36.3,-21.14,;35.39,-22.39,;36.15,-23.72,;35.37,-25.05,;36.12,-26.39,;37.66,-26.4,;38.44,-25.07,;39.98,-25.07,;40.75,-26.41,;42.29,-26.41,;39.97,-27.74,;41.51,-27.73,;37.68,-23.73,;33.92,-21.91,;32.58,-22.68,)|
O[C@H]1CC[C@H](CC1)Nc1ccc2nnn(-c3cccc(OC(F)(F)F)c3)c2n1 |r,wD:4.7,1.0,(-8.42,-37.15,;-8.41,-35.61,;-7.08,-34.85,;-7.07,-33.3,;-8.4,-32.53,;-9.74,-33.3,;-9.74,-34.84,;-8.4,-30.99,;-7.06,-30.22,;-7.06,-28.68,;-5.73,-27.91,;-4.4,-28.67,;-2.92,-28.19,;-2.01,-29.45,;-2.92,-30.7,;-2.17,-32.04,;-2.95,-33.36,;-2.19,-34.7,;-.65,-34.71,;.13,-33.38,;1.67,-33.38,;2.43,-34.72,;3.97,-34.73,;1.66,-36.05,;3.2,-36.04,;-.63,-32.04,;-4.4,-30.22,;-5.73,-30.99,)|
CN(C)c1cccc(c1)-n1nnc2ccc(NCC3CCNCC3)nc12
FC(F)(F)c1cccc(c1)-n1nnc2ccc(NCC3CC4(C3)CCNCC4)nc12
FC(F)(F)c1cccc(c1)-n1nnc2ccc(NC3CC4(C3)CCNCC4)nc12
CN1CCC(CNc2ccc3ncc(-c4cccc(OC(F)(F)F)c4)n3n2)CC1
COc1cc(NCC2CCNCC2)nc2n(nnc12)-c1cccc(OC(F)(F)F)c1
COc1cc(NCC2CCNCC2)nc2n(nnc12)-c1cccc(c1)N(C)C
FC(F)(F)Oc1cccc(c1)-n1nnc2cc(Cl)c(NCC3CCNCC3)nc12
O=Cc1cn2CCCCn3c4ccccc4c4ccc1c2c34
CC1(C)OCC(=O)Nc2cc(Nc3nc(NCC(F)(F)F)c4occc4n3)ccc12
CN(C)C\C=C\C(=O)Nc1cc(ccc1C)-n1c2c(ccc3ccc(cc23)-c2cnn(C)c2)ccc1=O
COC\C=C\c1c(Cl)c2c(Cl)cc(nc2n1C1CCCNC1)C(N)=O
Cn1c(cc2c1nc(cc2Cl)C(=O)N)c3ccc(cc3)N4CCN(CC4)C
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(CC3CCNC3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(CC3CCNCC3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(CC3CCCN3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CCNCC3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CCCNC3)c2n1
NC1CCC(CC1)n1c(I)c(Cl)c2c(Cl)cc(nc12)C(N)=O |(71.97,-24.68,;71.49,-23.21,;69.98,-22.89,;69.5,-21.44,;70.53,-20.3,;72.04,-20.6,;72.52,-22.06,;70.05,-18.83,;70.95,-17.58,;72.49,-17.57,;70.03,-16.34,;70.5,-14.87,;68.57,-16.82,;67.24,-16.06,;67.23,-14.52,;65.91,-16.83,;65.91,-18.37,;67.24,-19.15,;68.58,-18.37,;64.57,-19.14,;64.57,-20.68,;63.24,-18.37,)|
NC1CCCC(C1)n1c(I)c(Cl)c2c(Cl)cc(nc12)C(N)=O
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CCCNCC3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CN4CCC3CC4)c2n1 |(33.51,-30.79,;33.51,-29.25,;32.17,-28.49,;34.84,-28.49,;34.84,-26.94,;36.17,-26.17,;36.17,-24.63,;37.5,-26.94,;38.97,-26.45,;39.44,-24.98,;39.89,-27.69,;41.43,-27.68,;38.98,-28.95,;39.47,-30.41,;40.98,-30.71,;41.46,-32.18,;40.43,-33.33,;38.92,-33.01,;38.44,-31.55,;39.86,-31.35,;39.72,-32.56,;37.51,-28.48,;36.18,-29.26,)|
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CCC(O)CC3)c2n1 |(47.27,-30.19,;47.27,-28.65,;45.94,-27.88,;48.61,-27.88,;48.61,-26.34,;49.94,-25.57,;49.93,-24.03,;51.27,-26.33,;52.74,-25.85,;53.2,-24.38,;53.65,-27.09,;55.19,-27.08,;52.75,-28.34,;53.24,-29.8,;52.21,-30.94,;52.69,-32.4,;54.19,-32.72,;54.67,-34.18,;55.22,-31.57,;54.74,-30.1,;51.28,-27.87,;49.94,-28.65,)|
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CCCC(O)C3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CNC3)c2n1
CCN(CC)CCn1c(I)c(Cl)c2c(Cl)cc(nc12)C(N)=O
CSc1c(Cl)c2c(Cl)cc(nc2n1C1CCCNC1)C(N)=O
NC(=O)c1cc(Cl)c2c(Cl)c(-c3ccccc3)n(C3CCCNC3)c2n1
[#6]\[#6](-[#6])=[#6]\c1c(Cl)c2c(Cl)cc(nc2n1-[#6]-1-[#6]-[#6]-[#6]-[#7]-[#6]-1)-[#6](-[#7])=O
NC(=O)c1cc(Cl)c2c(Cl)c(C3CC3)n(C3CCCNC3)c2n1
Cn1cc(cn1)-c1c(Cl)c2c(Cl)cc(nc2n1C1CCCNC1)C(N)=O
COCC1CC1c1c(Cl)c2c(Cl)cc(nc2n1C1CCCNC1)C(N)=O
NC(=O)c1cc(Cl)c2c(Cl)c(C3=CCOCC3)n(C3CCCNC3)c2n1 |t:11|
CN1CCN(CC1)c1ccc(cc1)-c1c(C)c2c(Cl)cc(nc2n1C)C(N)=O
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(CCC3CCNCC3)c2n1
CN1CCC(CC1)n1c(I)c(Cl)c2c(Cl)cc(nc12)C(N)=O
NCC1CCC(CC1)n1c(I)c(Cl)c2c(Cl)cc(nc12)C(N)=O |(25.89,-37.44,;26.91,-36.3,;26.43,-34.83,;24.93,-34.51,;24.45,-33.06,;25.48,-31.92,;26.98,-32.22,;27.46,-33.68,;24.99,-30.45,;25.89,-29.2,;27.43,-29.19,;24.98,-27.96,;25.44,-26.49,;23.51,-28.44,;22.18,-27.68,;22.17,-26.14,;20.85,-28.45,;20.85,-29.99,;22.18,-30.77,;23.52,-29.99,;19.51,-30.76,;19.51,-32.3,;18.18,-29.99,)|
NC(=O)c1cc(Cl)c2c(Cl)c(I)n(C3CCNC(=O)C3)c2n1
Cn1c(I)c(Cl)c2c(Cl)cc(nc12)C(N)=O
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CC3)n(C3CCCNC3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(C3CCCO3)n(C3CCCNC3)c2n1
NC(=O)c1cc(Cl)c2c(Cl)c(n(C3CCCNC3)c2n1)C(F)(F)F
CC(C)NCc1ccc(Nc2cc(n[nH]2)-c2ccc(cc2)-c2ccc(O)cc2O)cc1
Cn1c(cc2c(Cl)ccnc12)-c1ccc(cc1)N1CCNCC1
CN1CCC(CC1)NC(=O)c1ccc(cc1)-c1c(-c2ccc(cc2)N2CCN(C)CC2)n(C)c2nccc(Cl)c12
Cn1c(cc2c(Cl)cc(nc12)C(N)=O)-c1ccc(cc1)N1CCNCC1
CN(C)Cc1ccc(cc1)-c1c(-c2ccc(cc2)N2CCNCC2)n(C)c2nc(cc(Cl)c12)C(N)=O
Cc1c(-c2ccc(cc2)N2CCNCC2)n(C)c2nc(cc(Cl)c12)C(N)=O
CN(C)Cc1ccc(cc1)-c1c(-c2ccc(cc2)N2CCN(C)CC2)n(C)c2nccc(Cl)c12
Cn1c(c(c2c1nccc2Cl)c3ccc(cc3)CO)c4ccc(cc4)N5CCNCC5
Clc1cc2NC(=O)Nc3cnc(C#N)c(OCCCCOc2cc1NCc1cncs1)n3
CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
C[C@@H]1O[C@@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O
NCCc1ccc(OC(=O)c2cc(O)c(O)c(O)c2)cc1
c1ccc2c(c1)nc-3n2C(=O)c4cccc5c4c3ccc5C(=O)O
OC1Nc2ccc(I)cc2C1=Cc1cc(Br)c(O)c(Br)c1
CCn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCN(C)CC1
CCn1cc(cn1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCOCC1
Cn1nc(-c2cccc(n2)N2CCC[C@H](N)C2)c2cc(ncc12)-c1cccnc1 |r|
Cn1cc(cn1)-c1cc2c(nn(C)c2cn1)-c1cccc(n1)N1CCC[C@H](N)C1 |r|
Cc1cncc(n1)-c1cc2n(ncc2nn1)-c1cccc(n1)N1CCCNCC1
Cc1cncc(n1)-c1ccc2cnn(-c3cccc(n3)N3CCCNCC3)c2c1
Cc1cncc(n1)-c1cnc2cnn(-c3cccc(n3)N3CCCNCC3)c2c1
Cc1cncc(n1)-c1cn2c(ncc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1cncc(n1)-c1cc2c(nsc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1cncc(n1)-c1cc2n(ncc2cn1)-c1cccc(n1)[C@H]1CNCCC1(F)F |r|
Cc1cncc(n1)-c1cc2n(ccc2cn1)-c1cccc(n1)N1CCCNCC1
Cc1cncc(n1)-c1cc(F)c2cnn(-c3cccc(n3)N3CCCNCC3)c2c1
Cc1cncc(n1)-c1cc2c(n[nH]c2cn1)-c1cccc(n1)N1CCCNCC1
N[C@H]1CCCN(C1)c1cccc(n1)-c1n[nH]c2cnc(cc12)-c1cccnc1 |r|
c1cc(c(c(c1)F)C(=O)n2c(nc(n2)Nc3ccc(cc3)S(=O)(=O)N)N)F
CC[C@H](CO)Nc1nc(NCc2ccccc2)c2ncn(C(C)C)c2n1 |r|
Oc1ccc(cc1)-c1nc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
COCC(=O)NC\C=C\c1ccc2ncnc(Nc3ccc(Oc4ccc(C)nc4)c(C)c3)c2c1
CCOc1cc2c(cc1NC(=O)/C=C/CN(C)C)c(c(cn2)C#N)Nc3ccc(c(c3)Cl)F
COc1ccc(cc1OC)C(=O)NCc1cccc(c1)C(=O)Nc1ccc2CCNCc2c1
CSc1ccccc1Nc2c3c(c(ncn3)NCC4CC4)nc(n2)N5CCNCC5
FC(F)(F)Oc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c(Cl)c1
Fc1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
Fc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)cc1
Fc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c(F)c1
Fc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)cc1F
Fc1cc(F)cc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
COc1ccccc1Nc1nc2c(cccc2c2sccc12)-c1nnc[nH]1
COc1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
COc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)cc1
CN(C)CCOc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)cc1
N#Cc1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
C#Cc1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
NC(=O)c1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)cc1
OC(=O)c1cccc2c3sccc3c(Nc3ccccc3Cl)nc12
NC(=O)c1cccc2c3sccc3c(Nc3ccccc3Cl)nc12
CNC(=O)c1cccc2c3sccc3c(Nc3ccccc3Cl)nc12
N(c1ccccc1)c1nc2c(cccc2c2sccc12)-c1nnc[nH]1
Clc1ccccc1Nc1nc2c(cccc2c2sccc12)-c1nnc[nH]1
Fc1ccccc1Nc1nc2c(cccc2c2sccc12)-c1nnc[nH]1
N(c1ccccc1)c1nc2c(cccc2c2cscc12)-c1nnc[nH]1
Clc1ccccc1Nc1nc2c(cccc2c2cscc12)-c1nnc[nH]1
N(c1ccccc1)c1nc2c(cccc2c2ccsc12)-c1nnc[nH]1
Clc1ccccc1Nc1nc2c(cccc2c2ccsc12)-c1nnc[nH]1
Clc1ccccc1Nc1nc2c(cccc2c2scnc12)-c1nnc[nH]1
N(c1ccccc1)c1nc2c(cccc2n2cccc12)-c1nnc[nH]1
Clc1ccccc1Nc1nc2c(cccc2n2cccc12)-c1nnc[nH]1
Fc1ccccc1Nc1nc2c(cccc2n2cccc12)-c1nnc[nH]1
Fc1ccccc1Nc1nc2c(cccc2n2cncc12)-c1nnc[nH]1
C1CN(CCO1)c1nc2c(cccc2c2sccc12)-c1nnc[nH]1
C(Nc1nc2c(cccc2c2sccc12)-c1nnc[nH]1)c1ccccc1
N(c1cccnc1)c1nc2c(cccc2c2sccc12)-c1nnc[nH]1
N(c1ccncc1)c1nc2c(cccc2c2sccc12)-c1nnc[nH]1
Clc1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
Clc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)cc1
Oc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c(Cl)c1
Fc1ccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c(Cl)c1
COc1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1Cl
Cc1cc2c(Nc3ccccc3F)nc3c(cccc3c2s1)-c1nnc[nH]1
C1CC1Nc1nc2c(cccc2c2sccc12)-c1nnc[nH]1
FC(F)(F)c1cccc(Nc2nc3c(cccc3c3sccc23)-c2nnc[nH]2)c1
COc1ccc2c(Oc3ccc(NC(=O)c4c(C)n(CC(C)(C)O)n(-c5ccccc5)c4=O)nc3)ccnc2c1
CC1=C(C(=O)N(N1C)c2ccccc2)C(=O)Nc3ccc(c(c3)F)Oc4ccnc5c4cc(c(c5)OC)OC
CN1CCCN(CC1)C(=O)c1ccc(F)c(c1)-c1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)o1
Clc1ccc2NC(=O)\C(=C\c3ccc(o3)-c3cccc(c3)C(=O)N3CCCNCC3)c2c1
CN1CCCN(CC1)C(=O)c1cncc(n1)-c1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)o1
CN1CCCN(CC1)C(=O)c1ccc(Cl)c(c1)-c1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)o1
CN1CCCN(CC1)C(=O)c1cccc(c1)-c1ccc(o1)C(C)=C1C(=O)Nc2ccc(Cl)cc12
CCC(=C1C(=O)Nc2ccc(Cl)cc12)c1ccc(o1)-c1cccc(c1)C(=O)N1CCCN(C)CC1
Clc1ccc2NC(=O)\C(=C\c3ccc(o3)-c3cccc(c3)C(=O)NCCN3CCCC3)c2c1
Fc1ccc2NC(=O)\C(=C\c3ccc(o3)-c3cccc(c3)C(=O)NCCN3CCCC3)c2c1
Clc1cccc2\C(=C/c3ccc(o3)-c3cccc(c3)C(=O)NCCN3CCCC3)C(=O)Nc12
Fc1ccc2NC(=O)\C(=C\c3ccc(o3)-c3cccc(c3)C(=O)NC3CC3)c2c1
OCCCNC(=O)c1cccc(c1)-c1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)o1
CN1CCCN(CC1)C(=O)c1cccc(c1)-c1ccc(\C=C2\C(=O)Nc3ccc(Cl)cc23)o1
Cc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
Clc1ccc(c(Cl)c1)-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
OC1CN(Cc2nc3c4cc(Br)ccc4oc3c(=O)[nH]2)C1
c1ccc(c(c1)C2=Nc3c4cc(ccc4oc3C(=O)N2)Br)Cl
Clc1ccccc1-c1nc2c3ccccc3oc2c(=O)[nH]1
Clc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
COc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
Oc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
Clc1ccccc1-c1nc2c3cc(ccc3oc2c(=O)[nH]1)C#N
Clc1ccccc1-c1nc2c3cc(ccc3oc2c(=O)[nH]1)-c1ccccc1
FC(F)(F)Oc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
FC(F)(F)c1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
Nc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
CNc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
CC(=O)Nc1ccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c2c1
Oc1ccc2c(c1)oc1c2nc([nH]c1=O)-c1ccccc1Cl
COc1ccc2c(c1)oc1c2nc([nH]c1=O)-c1ccccc1Cl
COc1cccc2oc3c(nc([nH]c3=O)-c3ccccc3Cl)c12
Fc1cccc(Cl)c1-c1nc2c3cc(ccc3oc2c(=O)[nH]1)C1CC1
COc1ccccc1-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
CC(C)c1ccccc1-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Fc1ccc(c(Cl)c1)-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Fc1ccc(Cl)c(c1)-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Fc1cccc(Cl)c1-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Clc1cccc(c1Cl)-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
COc1cccc(c1Cl)-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
NCc1ccc(c(Cl)c1)-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Clc1cc(ccc1-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1)C(=O)NCCN1CCCCC1
Clc1cc(CNC2CCNCC2)ccc1-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Clc1cc(NC(=O)CCN2CCCCC2)ccc1-c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
Brc1ccc2oc3c(nc([nH]c3=O)-c3ccc(NCC4CCNCC4)cc3)c2c1
Brc1ccc2oc3c(nc(CN4CCCCC4)[nH]c3=O)c2c1
Brc1ccc2oc3c(nc(CN4CCCC4)[nH]c3=O)c2c1
Brc1ccc2oc3c(nc(CN4CCC4)[nH]c3=O)c2c1
CN1CCN(CC1)CC2=Nc3c4cc(ccc4oc3C(=O)N2)Br
CC(N1CCN(C)CC1)c1nc2c3cc(Br)ccc3oc2c(=O)[nH]1
CN1C[C@@H]2C[C@H]1CN2Cc1nc2c3cc(Br)ccc3oc2c(=O)[nH]1 |r|
CN1C[C@@H]2CC[C@H]1CN2Cc1nc2c3cc(Br)ccc3oc2c(=O)[nH]1 |r|
N[C@H]1CCN(Cc2nc3c4cc(Br)ccc4oc3c(=O)[nH]2)C1 |r|
N[C@@H]1CCN(Cc2nc3c4cc(Br)ccc4oc3c(=O)[nH]2)C1 |r|
CN1CCCC(Cc2nc3c4cc(Br)ccc4oc3c(=O)[nH]2)C1
c1cc2c(cc1Br)c3c(o2)C(=O)NC(=N3)CN4CC[C@@H](C4)O
O[C@@H]1CCN(Cc2nc3c4cc(Br)ccc4oc3c(=O)[nH]2)C1 |r|
CN1CCN(Cc2nc3c4cc(Cl)ccc4oc3c(=O)[nH]2)CC1
CN1CCN(Cc2nc3c4cc(I)ccc4oc3c(=O)[nH]2)CC1
CN1CCN(Cc2nc3c4cc(ccc4oc3c(=O)[nH]2)C2CC2)CC1
CN1CCN(Cc2nc3c4cc(ccc4oc3c(=O)[nH]2)C(C)=O)CC1
Brc1ccc2oc3c(nc[nH]c3=O)c2c1
CCOc1cc(C=C2SC(O)=NC2=O)ccc1O |w:6.5,c:10|
COc1ccc(C=C2SC(O)=NC2=O)cc1OC |w:6.5,c:10|
OC1=NC(=O)C(S1)=Cc1ccccc1 |w:7.8,t:1|
CN(C)C1CCN(C1)c1ccccc1C=C1SC(O)=NC1=O |w:14.15,c:20|
CC(C)(C)OC(=O)N[C@H]1CCN(C1)c1ccccc1C=C1SC(O)=NC1=O |r,w:19.20,c:25|
OC1=NC(=O)C(S1)=Cc1ccccc1N1CCNCC1 |w:7.8,t:1|
N[C@H]1CCN(C1)c1ccccc1C=C1SC(O)=NC1=O |r,w:12.13,c:18|
N[C@H]1CCN(C1)c1c(Cl)cccc1C=C1SC(O)=NC1=O |r,w:13.14,c:19|
N[C@H]1CCN(C1)c1cc(Cl)ccc1C=C1SC(O)=NC1=O |r,w:13.14,c:19|
OC1=NC(=O)C(S1)=Cc1cccc(Cl)c1N1CCNCC1 |w:7.8,t:1|
N[C@@H]1CCCN(C1)c1c(Cl)cccc1C=C1SC(O)=NC1=O |r,w:14.15,c:20|
COc1cccc(C=C2SC(O)=NC2=O)c1N1CCC[C@@H](N)C1 |r,w:7.6,c:11|
N[C@@H]1CCCN(C1)c1c(C=C2SC(O)=NC2=O)cccc1-c1ccccc1 |r,w:9.9,c:14|
N[C@@H]1CCCN(C1)c1c(C=C2SC(O)=NC2=O)cccc1-c1ccncc1 |r,w:9.9,c:14|
N[C@@H]1CCCN(C1)c1ccccc1C=C1SC(O)=NC1=O |r,w:13.14,c:19|
N[C@@H]1CCCN(C1)c1c(Br)cccc1C=C1SC(O)=NC1=O |r,w:14.15,c:20|
CCOc1cccc(C=C2SC(O)=NC2=O)c1N1CCC[C@@H](N)C1 |r,w:8.7,c:12|
CC(C)COc1cccc(C=C2SC(O)=NC2=O)c1N1CCC[C@@H](N)C1 |r,w:10.9,c:14|
CC(C)Oc1cccc(C=C2SC(O)=NC2=O)c1N1CCC[C@@H](N)C1 |r,w:9.8,c:13|
COc1ccc2c(c1CN3CCNCC3)O/C(=C\c4c5ccccc5[nH]n4)/C2=O
FC(F)(F)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1cncc(OC2CCNCC2)n1
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1cncc(n1)N1CCNC1=O
NC1CCCN(C1)c1cncc(n1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cc(ccc3F)C#N)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)cc3F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(C)c3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(N)c3)c2c1
COc1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1cncc(NCCN(C)C)n1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(F)cc3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)S(C)(=O)=O)c2c1
CN(C)CCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C(F)(F)F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(F)c(c3)C(F)(F)F)c2c1
CN(C)CCCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C(F)(F)F)c2c1
CN(C)CCCN(C)c1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C(F)(F)F)c2c1
CN(C)CCN(C)c1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C(F)(F)F)c2c1
OCCc1cncc(n1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
Fc1ccccc1-c1c[nH]c2ccc(cc12)-c1cncc(n1)N1CCCNCC1
NCCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(c(F)c3)C(F)(F)F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)c(c3)C#N)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cc(ccc3F)C(O)=O)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cc(ccc3F)C(C)=O)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(F)c3F)c2c1
CCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccccc3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(C)cc3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C(F)(F)F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(c3)C(F)(F)F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(N)cc3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C#N)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(c3)C#N)c2c1
COc1cccc(c1)-c1c[nH]c2ccc(cc12)-c1cncc(NCCN(C)C)n1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(OC(F)(F)F)cc3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(OC(F)(F)F)c3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3cccc(F)c3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccccc3F)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)-c3ccccc3)c2c1
CN(C)CCNc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)S(N)(=O)=O)c2c1
FC(F)(F)c1ccc(cc1)-c1c[nH]c2ccc(cc12)-c1cncc(n1)N1CCNCC1
CN(C)CCCOc1cncc(n1)-c1ccc2[nH]cc(-c3ccc(cc3)C(F)(F)F)c2c1
CN1CCN(CC1)c2ccc(cc2)Nc3ncc4c(n3)n(c(n4)Nc5ccccc5)C6CCCC6
CC(C)(C)Nc1c(Nc2ccnc(Nc3ccc(cc3)-c3ccncc3)n2)c(=O)c1=O
c1cc(c(cc1Cl)CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCOC4=O)Cl
Clc1ccc(Cl)c(CNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)c1
COc1ccccc1CNc2ncc(c(n2)NC3CCCC3)C(=O)NCCCN4CCCC4=O
COc1ccc(CCNc2ncc(C(=O)NCCCN3CCCC3=O)c(NC3CCCC3)n2)cc1OC
F[C@H]1CNCC[C@@H]1CNc1ccn2ncc(C(=O)Nc3c[nH]c4ncc(cc34)-c3c(F)cccc3F)c2n1 |r|
F[C@H]1CNCC[C@@H]1CNc1ccn2ncc(C(=O)Nc3c[nH]c4ncc(cc34)-c3ccccc3F)c2n1 |r|
Fc1ccccc1-c1cnc2[nH]cc(NC(=O)c3cnn4ccc(NCC5CCNCC5)nc34)c2c1
FC1(CNc2ccn3ncc(C(=O)Nc4c[nH]c5ncccc45)c3n2)CCNCC1
F[C@@H]1CNCC[C@H]1CNc1ccn2ncc(C(=O)Nc3c[nH]c4ncccc34)c2n1 |r|
F[C@H]1CNCC[C@@H]1CNc1ccn2ncc(C(=O)Nc3c[nH]c4ncccc34)c2n1 |r|
F[C@@H]1CNCC[C@@H]1CNc1ccn2ncc(C(=O)Nc3c[nH]c4ncccc34)c2n1 |r|
F[C@H]1CNCC[C@H]1CNc1ccn2ncc(C(=O)Nc3c[nH]c4ncccc34)c2n1 |r|
Fc1cccc(F)c1-c1cnc2[nH]cc(NC(=O)c3cnn4ccc(OCC5CCNCC5)nc34)c2c1
Fc1cccc(F)c1-c1cnc2[nH]cc(NC(=O)c3cnn4ccc(CCC5CCNCC5)nc34)c2c1
Fc1cccc(F)c1-c1ccc2[nH]cc(NC(=O)c3cnn4ccc(NCC5CCNCC5)nc34)c2n1
Fc1cccc(F)c1-c1ccc2[nH]cc(NC(=O)c3cnn4ccc(NCC5CCNCC5)nc34)c2c1
Fc1cccc(F)c1-c1cnc2[nH]cc(NC(=O)c3cnn4ccc(NCC5CCNCC5)nc34)c2c1
O=C(Nc1c[nH]c2ncccc12)c1cnn2ccc(NCC3CCNCC3)nc12
O=C(Nc1c[nH]c2ncccc12)c1cnn2ccc(NCCc3ccccc3)nc12
O=C(Nc1c[nH]c2ncccc12)c1c[nH]n2c1nc(Cc1ccc(cc1)C#N)cc2=O
Fc1ccc(NC(=O)c2c[nH]n3c2nc(Cc2ccc(cc2)C#N)cc3=O)cc1
Fc1ccc(NC(=O)c2c[nH]n3c2nc(cc3=O)C2CCNCC2)cc1
NCCNc1ccn2ncc(-c3cccc(OCc4ccccc4)c3)c2n1
Cc1nnc(o1)-c1cccc(c1)-c1cnn2ccc(NCCN)nc12
NCCNc1ccn2ncc(-c3cccc(c3)-c3ccccc3)c2n1
NCCNc1ccn2ncc(-c3ccc4cn[nH]c4c3)c2n1
NCCNc1ccn2ncc(-c3ccc4[nH]c(=O)[nH]c4c3)c2n1
NCCNc1ccn2ncc(-c3ccc4scnc4c3)c2n1
NCCNc1ccn2ncc(-c3ccc4sccc4c3)c2n1
CN(C)CCNc1ccn2c(n1)c(cn2)c3c[nH]nc3
NCCNc1ccn2ncc(-c3cccc(c3)-c3ccco3)c2n1
CCN1CCCC1CNc1ccn2ncc(-c3ccc4ccccc4c3)c2n1
NCCCNc1ccn2ncc(-c3ccc4ccccc4c3)c2n1
C1NCC1Nc1ccn2ncc(-c3ccc4ccccc4c3)c2n1
NCCNc1ccn2ncc(-c3ccc4ccccc4c3)c2n1
C1CN(CCN1)c1ccn2ncc(-c3ccc4ccccc4c3)c2n1
c1ccc2cc(ccc2c1)c3cnn4c3nc(cc4)N[C@@H]5CCCC[C@H]5N
N[C@H]1CC[C@@H](CC1)Nc1ccn2ncc(-c3ccc4ccccc4c3)c2n1 |r,wU:1.0,wD:4.7,(62.54,-18.45,;63.88,-17.68,;63.89,-16.14,;65.21,-15.38,;66.54,-16.16,;66.55,-17.69,;65.21,-18.46,;67.88,-15.39,;69.21,-16.16,;69.21,-17.7,;70.54,-18.47,;71.87,-17.7,;73.35,-18.18,;74.26,-16.93,;73.35,-15.67,;73.83,-14.21,;72.8,-13.07,;73.27,-11.61,;74.78,-11.28,;75.24,-9.82,;76.76,-9.51,;77.8,-10.65,;77.32,-12.12,;75.81,-12.43,;75.34,-13.89,;71.87,-16.15,;70.54,-15.39,)|
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(CC2)C2CCC3(CC2)OCCO3)cc1
CC(C)Nc1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN(C)c1ccc(Oc2cc(O)cc(O)c2-c2cc(no2)C(=O)NC2CCN(C)CC2)cc1
CN1CCC(CC1)NC(=O)c2cc(on2)c3c(cc(cc3Oc4ccc(cc4)[N+](=O)[O-])O)O
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccc1C(F)(F)F |r|
COc1ccccc1-c1ccc(N)c(n1)C(=O)Nc1cnccc1N1CCC[C@H](N)C1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1ccnc(N)n1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1ccncc1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1cccnc1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)-c1ccccn1 |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(Oc2ccccc2)ccc1N |r|
N[C@@H]1CN(CC[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1ncccc1N |r|
c1cncc(c1N2CCC[C@@H](C2)N)NC(=O)c3c(nccn3)N
NCC1CCCN(C1)c1ccncc1NC(=O)c1nccnc1N
NCCC(=O)N1CCN(CC1)c1ccncc1NC(=O)c1nccnc1N
NCC(=O)N1CCN(CC1)c1ccncc1NC(=O)c1nccnc1N
Nc1nccnc1C(=O)Nc1cnccc1N1CCNCC1
Nc1nccnc1C(=O)Nc1cnccc1N1CCCCC1
CC(=O)Nc1nc(cs1)C(=O)Nc1cnc(N)cc1N1CCCCC1
CC(=O)Nc1nc(cs1)C(=O)Nc1cnc(N)nc1N1CCCCC1
CC(=O)Nc1nc(cs1)C(=O)Nc1cncnc1N1CCCCC1
CC(=O)Nc1nc(cs1)C(=O)Nc1cnccc1N1CCCCC1
CC(=O)Nc1nc(cs1)C(=O)Nc1ccncc1N1CCCCC1
O=C(Nc1ccccc1N1CCCCC1)c1ncc[nH]1
Nc1cccc(n1)C(=O)Nc1ccccc1N1CCCCC1
Oc1cccnc1C(=O)Nc1ccccc1N1CCCCC1
Nc1cccnc1C(=O)Nc1ccccc1N1CCCCC1
Nc1nccnc1C(=O)Nc1ccccc1N1CCCCC1
O=C(Nc1ccccc1N1CCCCC1)c1cscn1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(C(O)=O)c(F)c3)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3csc(c3)C(O)=O)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(CN)cc3)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(cc3Cl)C(O)=O)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(cc3F)C(O)=O)c2c1
COc1cc(ccc1-c1cncc(n1)-n1ncc2ccc(NC(C)C)cc12)C(O)=O
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(C(O)=O)c(C)c3)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(cc3)-c3nnn[nH]3)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(cc3)C(O)C(F)(F)F)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(CNC(C)=O)cc3)c2c1
CC(C)Nc1ccc2ccn(-c3cncc(n3)-c3ccc(cc3)C(O)=O)c2c1
CC(=O)NCCCC(=O)Nc1ccc2cnn(-c3cncc(n3)C#N)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(NCCCNC(C)=O)n3)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(NCCCN)n3)c2c1
CC(C)Nc1ccc2cnn(c2c1)c3cncc(n3)c4ccc(cc4)C(=O)O
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(cn3)C(O)=O)c2c1
CC(=O)Nc1cccc(c1)-c1ccc2cnn(-c3cncc(n3)C#N)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3cccc(c3)C(O)=O)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(nc3)C(O)=O)c2c1
CC(C)Nc1ccc2cnn(-c3cncc(n3)-c3ccc(cc3)C(=O)NS(C)(=O)=O)c2c1
CC(=O)NCC(=O)Nc1ccc2cnn(-c3cncc(n3)C#N)c2c1
CC(=O)NCCC(=O)Nc1ccc2cnn(-c3cncc(n3)C#N)c2c1
O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1
O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12
OC(=O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1ccccc1F |r|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
N[C@H]1CCC[C@H](C1)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F
C[C@@H]1C[C@H](N)CN(C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,3.3,(-2.4,-6.01,;-1.33,-5.39,;0,-6.16,;1.34,-5.39,;2.41,-6,;1.33,-3.85,;,-3.08,;-1.33,-3.85,;,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-4,-.77,;-4,.47,;-5.34,-1.53,;-6.67,-.76,;-8.01,-1.53,;-8.01,-3.07,;-9.07,-3.69,;-6.67,-3.84,;-5.34,-3.07,;-6.67,-5.38,;-8.01,-6.16,;-9.07,-5.54,;-8,-7.7,;-6.67,-8.46,;-5.34,-7.69,;-5.34,-6.15,;-4.27,-5.53,)|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:1.0,(2.41,-6,;1.34,-5.39,;0,-6.16,;-1.33,-5.39,;-1.33,-3.85,;,-3.08,;1.33,-3.85,;,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-4,-.77,;-4,.47,;-5.34,-1.53,;-6.67,-.76,;-8.01,-1.53,;-8.01,-3.07,;-9.07,-3.69,;-6.67,-3.84,;-5.34,-3.07,;-6.67,-5.38,;-8.01,-6.16,;-9.07,-5.54,;-8,-7.7,;-6.67,-8.46,;-5.34,-7.69,;-5.34,-6.15,;-4.27,-5.53,)|
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(ccc1N)C1CCCCC1 |r|
C[C@H]1CN(CCN1)c1cccc2nc(-c3nc(cnc3N)-c3cc(ccn3)C(=O)N(C)C)n(C)c12 |r|
CC(C)n1c(C)nc2c(F)cc(cc12)-c1nc(Nc2ccc3CN(CCN(C)C)CCc3n2)ncc1F
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCCC(O)CC1
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCC[C@H](N)CC1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCCNCC1
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCC[C@@H](CC1)NCC(F)(F)F |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCC[C@@H](CC1)NCC(F)F |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CC[C@@H](N)C(F)(F)CC1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CC[C@@H](N)CC(F)(F)C1 |r|
CO[C@@H]1CCN(CC[C@H]1N)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnn1C |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCC(N)CC(F)C1
CO[C@H]1C[C@H](N)CCN(C1)c1c(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)cnn1C |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1C1CCC(N)C(F)CC1
N[C@H]1CCCN(C1)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F
Cn1ncc(NC(=O)c2csc(n2)-c2c(F)cccc2F)c1N1CCC[C@H](N)CC1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CC[C@@H](N)[C@H](F)CC1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CC[C@@H](N)[C@@H](O)CC1 |r|
Cn1ncc(NC(=O)c2nc(sc2N)-c2c(F)cccc2F)c1N1CCCC(N)C(F)C1
[H][C@]12C[C@@H](NCCOCCOCCOCCNC(=O)CCC3=[N+]4C(C=C3)=Cc3c(C)cc(C)n3[B-]4(F)F)[C@@H](OC)[C@](C)(O1)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r,c:24,26,t:21|
COc1cc(Br)cc2[nH]cc(-c3oc(nc3I)-c3ccc[nH]3)c12
COc1cc2c(c[nH]c2cc1Br)-c1cnc(o1)-c1ccc[nH]1
COc1cc(Br)cc2[nH]cc(-c3cnc(o3)-c3ccc[nH]3)c12
COc1cc(Br)cc2[nH]cc(-c3cnc(o3)-c3cc(Br)c[nH]3)c12
COc1cc(Br)cc2[nH]cc(-c3cnc(o3)-c3ccc(Br)[nH]3)c12
COc1cc(Br)cc2[nH]c(I)c(-c3cnc(o3)-c3ccc[nH]3)c12
COCCN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2ccnc(NC3CCCCC3)c2c1
CN1CCC(CNc2cccc3ccc(nc23)-c2nnc3c4OCCN(C)c4cnn23)CC1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCNCC3)c2n1
CN1CCC(CC1)Nc1cccc2ccc(nc12)-c1nnc2c3OCCN(C)c3cnn12
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCCCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(N3CCC(N)CC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCC(C)(C)CC3)c2n1
C(CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2n1)Oc1ccccc1
CCCN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2n1
CC(C)N1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2ccc(Cl)c(NCC3(F)CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cc(Cl)cc(NCC3(F)CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2ccnc(NCC3CCNCC3)c2c1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2ccnc(NCC3(F)CCNCC3)c2c1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2c1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2c(F)c(F)cc(NCC3(F)CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(N3CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCOCC3)c2n1
CCN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC3CCCCC3)c2c1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3(F)CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCOCC3)c2c1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NC(=O)C3CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCOCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cccc(NCC3CCCCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cc(F)cc(NCC3(F)CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2cc(C)cc(NCC3(F)CCNCC3)c2n1
CN1CCOc2c1cnn1c(nnc21)-c1ccc2c(F)ccc(NCC3(F)CCNCC3)c2n1
[H][C@]12C[C@H](O)[C@@H](O)[C@](C)(O1)n1c3ccccc3c3c4C(=O)NC(=O)c4c4c5ccccc5n2c4c13 |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C[C@@H]1CCCO1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CC(C)(C)N)c2=O |r|
CC(c1cn(C)cn1)n1c(NC(C)(C)C)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1 |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(c2=O)C(C)(C)C |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CC1(N)CC1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CC1(O)CC1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(c2=O)C1(C)CC1 |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(c2=O)C(C)(C)C |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C[C@@H]1CN(C)CCO1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(Cc1cn(C)cn1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(c2=O)C1(C)CC1 |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(CC1CC1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(CC1(O)CC1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(CC1(N)CC1)c2=O |r|
C[C@H](c1cn(C)cn1)n1c(NC2(C)CC2)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1 |r|
C[C@@H](c1cn(C)cn1)n1c(NC2(C)CC2)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1 |r|
CC(c1cn(C)cn1)n1c(NC2(C)CC2)nc2c(cccc2c1=O)-c1cc2C(=O)N[C@H](C)c2[nH]1 |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC1(C)CC1)n(C1CCC1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C[C@H]1CN(C)CCO1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CC1COC1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(C[C@H]1CCCO1)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)C)n(CC1CC1)c2=O |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CCCO3)n([C@H]3CCCNC3)c2n1 |r|
CC(C)(CC#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O)C(N)=O |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CCO)n([C@H]3CCCNC3)c2n1 |r|
CC(O)C#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
CC(O)CC#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
COCCC#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
COCC(C)(C)C#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3COCCO3)n([C@H]3CCCNC3)c2n1 |r|
CC1(CC#Cc2c(Cl)c3c(Cl)cc(nc3n2[C@H]2CCCNC2)C(N)=O)COC1 |r|
CN1CC(CC1=O)C#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CCN3CCCC3=O)n([C@H]3CCCNC3)c2n1 |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CNCCO3)n([C@H]3CCCNC3)c2n1 |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CCCO)n([C@H]3CCCNC3)c2n1 |r|
CC(C)(CC#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O)C#N |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CC3)n([C@H]3CCCNC3)c2n1 |r|
CC(C)(O)C#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
CC1(COC1)C#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
COC(C)(C)CC#Cc1c(Cl)c2c(Cl)cc(nc2n1[C@H]1CCCNC1)C(N)=O |r|
NC(=O)c1cc(Cl)c2c(Cl)c(C#CC3CCOCC3)n([C@H]3CCCNC3)c2n1 |r|
CN(C)c1ccc(cc1)C(=O)Nc1cccc(NC(=O)COc2ccc3c(c2)occc3=O)c1
Cc1nc2cccc(-c3cc4CNC(=O)c4s3)c2nc1NC(C)(C)C
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(N(C)C(C)(C)C)n(C)c2=O |r|
Cc1nc2ccc(F)c(-c3cc4c(CCNC4=O)[nH]3)c2nc1NC(C)(C)C
Cc1nc2cccc(-c3cc4C(=O)N[C@H](CCN)c4[nH]3)c2nc1NC(C)(C)C |r|
Cc1nc2cccc(-c3cc4C(=O)NCc4s3)c2nc1NC(C)(C)C
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(NC(C)(C)CO)n(C)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(N1CCCC1(C)C)n(C)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1nc(CC(C)(C)C)n(C)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccc2c1N=C(NC(C)(C)C)N(C)S2(=O)=O |r,t:19|
C[C@H]1NC(=O)c2cc([nH]c12)-c1cccn2c1nc(NC(C)(C)C)c(C)c2=O |r|
C[C@H]1NC(=O)c2cc([nH]c12)-c1nccc2c1nc(NC(C)(C)C)n(C)c2=O |r|
CN1CCC(CNC2=NC(=O)\C(S2)=C\c2csc(n2)-c2ccc(OC(F)(F)F)cc2)CC1 |t:7|
N[C@H]1CCCN(C1)c1c(\C=C2/SC(=O)NC2=O)cccc1-c1ccccc1 |r|
C[C@@H]1C[C@H](N)C[C@@H](C1)c1ccccc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:6.8,1.0,3.3,(34.39,-20.74,;33.06,-21.51,;31.73,-20.73,;30.39,-21.51,;29.06,-20.73,;30.39,-23.05,;31.72,-23.81,;33.06,-23.04,;31.73,-25.34,;30.4,-26.11,;30.4,-27.66,;31.73,-28.42,;33.07,-27.65,;33.07,-26.11,;34.4,-25.33,;35.74,-26.1,;35.74,-27.63,;37.07,-25.32,;38.4,-26.09,;39.72,-25.31,;39.72,-23.77,;41.05,-23,;38.38,-23.01,;37.05,-23.79,;38.36,-21.48,;39.69,-20.7,;41.03,-21.46,;39.68,-19.16,;38.34,-18.4,;37.02,-19.19,;37.03,-20.72,;35.71,-21.51,)|
C[C@@H](n1cc(C)c2c(Cl)cc(nc12)C(N)=O)[C@@]1(F)CCNC1 |r|
C[C@H](n1cc(C)c2c(Cl)cc(nc12)C(N)=O)[C@@]1(F)CCNC1 |r|
Cc1cn(c2c1c(cc(n2)C(=O)N)Cl)[C@@H](C)[C@@]3(CCNC3)F
C[C@@H](n1cc(C)c2c(Cl)cc(nc12)C(N)=O)[C@]1(F)CCNC1 |r|
[H][C@@]1(CCNC[C@@H]1F)[C@@H](C)n1cc(C)c2c(Cl)cc(nc12)C(N)=O |r|
[H][C@]1(CCNC[C@H]1F)[C@@H](C)n1cc(C)c2c(Cl)cc(nc12)C(N)=O |r|
[H][C@@]1(CCNC[C@H]1F)[C@H](C)n1cc(C)c2c(Cl)cc(nc12)C(N)=O |r|
[H][C@]1(CCNC[C@@H]1F)[C@H](C)n1cc(C)c2c(Cl)cc(nc12)C(N)=O |r|
OC(=O)CSc1ncnc2cc(sc12)-c1cc2ccccc2s1
C[C@H]1C[C@H](C[C@@H](O)[C@@]1(O)CF)c1ccncc1NC(=O)c1nc(ncc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@@]1(O)CF)c1ccncc1NC(=O)c1nc(ccc1N)-c1ncccc1F |r|
CC[C@@]1(O)[C@@H](C)C[C@H](C[C@H]1O)c1ccncc1NC(=O)c1nc(ccc1N)-c1ncccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1nc(ccc1N)-c1ncccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1nc(ccc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1nc(ncc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1nc(sc1N)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1ccnc(n1)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1csc(n1)-c1c(F)cccc1F |r|
C[C@H]1C[C@H](C[C@@H](O)[C@]1(C)O)c1ccncc1NC(=O)c1ccc(F)c(n1)-c1c(F)cccc1F |r,wU:7.9,wD:1.0,5.5,3.10,(30.93,-25.95,;32.26,-26.73,;32.26,-28.27,;33.59,-29.05,;34.92,-28.29,;34.94,-26.75,;36.27,-25.99,;33.6,-25.96,;32.82,-24.63,;34.37,-24.62,;33.57,-30.59,;32.24,-31.35,;32.23,-32.89,;33.56,-33.67,;34.9,-32.91,;34.9,-31.37,;36.25,-30.61,;37.58,-31.38,;37.56,-32.92,;38.91,-30.62,;40.24,-31.4,;41.58,-30.63,;41.59,-29.09,;42.93,-28.33,;40.26,-28.32,;38.92,-29.08,;40.27,-26.78,;38.94,-26,;37.6,-26.76,;38.95,-24.46,;40.29,-23.7,;41.62,-24.47,;41.61,-26.01,;42.93,-26.79,)|
CC(C)Oc1cc(F)ccc1Nc1ncnc2ccc(nc12)-c1ccc(cc1)C(=O)N1CCNCC1
COc1ncc-2cc1NS(=O)(=O)c1cccc(c1)C(=O)NCc1ccc(s1)-c1ncnc3c(C)c-2sc13
COc1ncc-2cc1NS(=O)(=O)c1ccc(F)c(c1)C(=O)NCc1ccc(s1)-c1ncnc3c(C)c-2sc13
CCN(CC)c1cnc2ccc(cc2n1)-c1nc(Nc2ccc(cn2)N2CCNCC2)ncc1F
COc1cc(F)ccc1-c1cnc2sc(nn12)N1CCC(C)(N)CC1
CC(C)(N)CNc1nn2c(cnc2s1)-c1ccc(F)cc1F
Clc1cccc(c1)-n1ncc2c1nc(SCC#N)[nH]c2=O
CC(C)(Sc1nc2n(ncc2c(=O)[nH]1)-c1ccccc1)C(N)=O
CCC(Sc1nc2n(ncc2c(=O)[nH]1)-c1cccc(F)c1)C(N)=O
CC1=CC(=O)Oc2c1cc3ccc(c(c3c2)[N+](=O)[O-])O
FC(F)c1c(Br)c(Br)cc2c1nc(N1CCNCC1)n2C1CCOCC1
Cc1c(Br)c(Br)c2CCCn3c(nc1c23)N1CCNCC1
CNCCCn1c2ccccc2c2c3cn[nH]c3c3c4ccccc4[nH]c3c21
C[C@@H]1CCCN(c2c(/C=C3SC(=O)NC3=O)cccc2-c2ccccc2)C1
CN1CCC(CNc2ccc3ncc(-c4cccc(OC(F)(F)F)c4)n3n2)CC1
CC(C)n1c(C2CCNCC2)nc2c([N+](=O)[O-])c(Br)c(Br)cc21
CC(C)(O)[C@H]1CC[C@@H](CC1)Nc1ccc2ncc(-c3cccc(c3)C(F)(F)F)n2n1 |r,wU:7.10,wD:4.3,(-8.7,2.48,;-7.36,3.25,;-7.36,4.79,;-8.7,4.02,;-6.03,2.48,;-6.03,.94,;-4.7,.17,;-3.36,.94,;-3.36,2.48,;-4.7,3.25,;-2.03,.17,;-.69,.94,;-.69,2.48,;.64,3.25,;1.97,2.48,;3.44,2.96,;4.34,1.71,;3.44,.47,;3.84,-1.02,;2.75,-2.11,;3.15,-3.6,;4.63,-4,;5.82,-2.9,;5.32,-1.42,;7.31,-3.28,;8.8,-3.66,;6.93,-4.77,;7.69,-1.79,;1.97,.94,;.64,.17,)|
CC1NC(=O)c2cc(-c3cccc4c(=O)n(C5(C)CC5)c(NC5(C)CC5)nc34)[nH]c21
O=C(O)c1nc2ccc(Cl)cc2nc1Nc1cccc(O)c1
O=C(O)c1nc2ccc(Br)cc2nc1Nc1cccc(O)c1
N#Cc1c(-c2cc3cc(Cl)ccc3nc2N2CCOCC2)cc(-c2cccc(O)c2)[nH]c1=O
COc1ccc2nc(N3CCOCC3)c(-c3cc(-c4cccc(O)c4)[nH]c(=O)c3C#N)cc2c1
COc1ccc2nc(N3CCCCC3)c(-c3cc(-c4cccc(O)c4)[nH]c(=S)c3C#N)cc2c1
CCOc1cc(ccc1O)/C=C\2/C(=O)NC(=S)S2
CN1CCN(c2ccc(-n3cnc4ccc(/C=C5SC(=S)NC5=O)cc43)cc2)CC1
CN1CCN(c2ccc(-c3cnc4ccc(/C=C5SC(=O)NC5=O)nn34)cc2)CC1
CCN1CCN(c2ccc(-c3cnc4ccc(/C=C5SC(=O)NC5=O)nn34)cc2F)CC1
Cc1ccc(-c2cncc(NCCN(C)C)n2)cc1CC1SC(=O)NC1=O
CN(C)CCNc1cncc(-c2cccc(/C=C3SC(=S)NC3=O)c2)n1
Cc1ccc(C(C)C)c(O)c1/C=N/N=C1NC(=O)C(CC(=O)O)S1
COc1ccc(N2C(=O)C(CC(=O)O)S/C2=N/N=C/c2c(C)ccc(C(C)C)c2O)cc1
Cc1ccc(C(C)C)c(O)c1/C=N/N=C1/SC(CC(=O)O)C(=O)N1c1cccc2ccccc12
CN1CCN(C[C@@H](NC(=O)CC2CNC(=O)c3cc(-c4cccc(Cl)c4)cn32)C2CCCCC2)CC1
COc1ccc(/C=C/C(=N)/C=C2/C(=O)Nc3cc(Br)ccc32)cc1
COc1ccc(/C=C/C(=O)CC2(O)C(=O)Nc3cc(Br)ccc32)cc1
COc1ccc(/C=C/C(=O)/C=C2/C(=O)Nc3cc(Br)ccc32)cc1
COc1ccc(/C=C/C(/C=C2/C(=O)Nc3cc(Br)ccc32)=N/O)cc1
CN1CCN(Cc2ccc(NC(=O)c3n[nH]cc3Nc3ncnc4[nH]ccc34)cc2)CC1
Cc1oncc1C(=O)Nc1ccc(cc1)C(F)(F)F
N[C@H]1CC[C@H](Oc2ccncc2NC(=O)c2csc(-c3c(F)cccc3F)n2)CC1
N[C@H]1CC[C@@H](Oc2ccncc2NC(=O)c2csc(-c3c(F)cccc3F)n2)CC1
O=C(Nc1cnccc1OC1CC2CCC(C1)N2)c1csc(-c2c(F)cccc2F)n1
O=C(Nc1cnccc1OCC1CCNCC1)c1csc(-c2c(F)cccc2F)n1
O=C(Nc1cnccc1OCC1CNC1)c1csc(-c2c(F)cccc2F)n1
NCCCOc1ccncc1NC(=O)c1csc(-c2c(F)cccc2F)n1
NCCCCOc1ccncc1NC(=O)c1csc(-c2c(F)cccc2F)n1
C[C@@H](C(F)(F)F)N(Cc1ccc(cc1)F)C(=O)CN2C(=O)[C@]3(CCc4c3ccc(c4)NC(=O)NC)OC2=O
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C
Cc1cc2c(c[nH]c2nc1)Cc3ccc(nc3F)NCc4cc(cnc4OC)F
C=CC(=O)Nc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12
CNC(=O)c1cc(Oc2ccc(NC(=O)Nc3cc(nn3-c3ccc4ncccc4c3)C(C)(C)C)c(F)c2)ccn1
c1cc(c(cc1I)F)Nc2c(ccc(c2F)F)C(=O)N3CC(C3)([C@@H]4CCCCN4)O
CCN1CCN(Cc2ccc(Nc3ncc(F)c(n3)-c3cc(F)c4nc(C)n(C(C)C)c4c3)nc2)CC1
CCc1cccc(CC)c1NC(=O)c1nn(C)c-2c1CCc1cnc(Nc3ccc(cc3OC(F)(F)F)C(=O)NC3CCN(C)CC3)nc-21
O=C1c2ccccc2-c2n[nH]c3cccc1c23
CC[C@@H]1CN(C[C@@H]1c1cnc2cnc3[nH]ccc3n12)C(=O)NCC(F)(F)F |r|
C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)NC)OC