933 SMILES Strings for Thyroid hormone receptor beta

Compound Name
SMILES String
N[C@@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O |r|
c1cc(c(cc1Oc2c(cc(cc2I)CC(=O)O)I)I)O
CC(C)c1cc(Oc2c(I)cc(C[C@@H](N)C(O)=O)cc2I)ccc1O |r|
OC(=O)CCc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1
CC(C)c1cc(ccc1O)Oc2c(cc(cc2Br)CCC(=O)O)Br
CC(C)c1cc(Oc2c(Br)cc(cc2Br)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(Br)cc(CC(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)C(O)=O)ccc1O
CC(C)c1cc(ccc1O)Oc2c(cc(cc2Cl)CC(=O)O)Cl
CC(C)c1cc(Oc2c(Cl)cc(CCC(O)=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(Br)cc(CC(=O)NCC(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(Br)cc(CC(=O)N[C@@H](C)C(O)=O)cc2Br)ccc1O |r|
CC(C)c1cc(Oc2c(Br)cc(CC(=O)N[C@H](C)C(O)=O)cc2Br)ccc1O |r|
CC(C)[C@H](NC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(C)C)c(Br)c1)C(O)=O |r|
CC(C)[C@@H](NC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(C)C)c(Br)c1)C(O)=O |r|
CC(C)c1cc(Oc2c(Br)cc(CC(=O)N[C@H](C(O)=O)c3ccccc3)cc2Br)ccc1O |r|
CC(C)c1cc(Oc2c(Br)cc(CC(=O)N[C@@H](C(O)=O)c3ccccc3)cc2Br)ccc1O |r|
CC(C)c1cc(Oc2c(Br)cc(CC(=O)N[C@@H](CC(O)=O)C(O)=O)cc2Br)ccc1O |r|
CC(C)c1cc(Oc2c(Br)cc(CC(=O)N[C@@H](CCO)C(O)=O)cc2Br)ccc1O |r|
CC(C)[C@H](NC(=O)Cc1cc(Br)c(Oc2cc(F)c(O)c(c2)C(C)C)c(Br)c1)C(O)=O |r|
CC(C)[C@H](NC(=O)Cc1cc(Br)c(Oc2cc(Cl)c(O)c(c2)C(C)C)c(Br)c1)C(O)=O |r|
CC(C)[C@H](NC(=O)Cc1cc(Br)c(Oc2cc(C)c(O)c(c2)C(C)C)c(Br)c1)C(O)=O |r|
CC(C)c1cc(Oc2c(Br)cc(cc2Br)C(O)=O)cc(C(C)C)c1O
CC(C)c1cc(Cc2c(C)cc(OCC(O)=O)cc2C)cc(c1O)-c1ccc(cc1)[N+]([O-])=O
CC(C)c1cc(Cc2c(C)cc(OCC(O)=O)cc2C)cc(C#Cc2ccc(cc2)[N+]([O-])=O)c1O
CC(C)c1cc(Oc2c(Br)cc(CCC(O)=O)cc2Br)cc(\C=C\c2ccncc2)c1O
OC(=O)CCc1cc(Br)c(OCC2CCCCC2)c(Br)c1
OC(=O)CCc1cc(Br)c(OCc2ccccc2)c(Br)c1
Cc1ccccc1COc1c(Br)cc(CCC(O)=O)cc1Br
Cc1cccc(COc2c(Br)cc(CCC(O)=O)cc2Br)c1
Cc1ccc(COc2c(Br)cc(CCC(O)=O)cc2Br)cc1
OC(=O)CCc1cc(Br)c(OCc2cccc(c2)C(F)(F)F)c(Br)c1
OC(=O)CCc1cc(Br)c(OCc2cccc(Cl)c2)c(Br)c1
OC(=O)CCc1cc(Br)c(OCc2cccc(Br)c2)c(Br)c1
Nc1cccc(COc2c(Br)cc(CCC(O)=O)cc2Br)c1
CCNc1cccc(COc2c(Br)cc(CCC(O)=O)cc2Br)c1
CCN(CC)c1cccc(COc2c(Br)cc(CCC(O)=O)cc2Br)c1
CCOc1c(Br)cc(CC(O)=O)cc1Br
CCCCOc1c(Br)cc(CC(O)=O)cc1Br
CCCCCOc1c(Br)cc(CC(O)=O)cc1Br
CC(C)CCOc1c(Br)cc(CC(O)=O)cc1Br
CCCCCCOc1c(Br)cc(CC(O)=O)cc1Br
CCC(CC)COc1c(Br)cc(CC(O)=O)cc1Br
OC(=O)Cc1cc(Br)c(OCC2CCCCC2)c(Br)c1
CC(C)CCOc1c(Br)cc(CCC(O)=O)cc1Br
CCCCCCOc1c(Br)cc(CCC(O)=O)cc1Br
CCC(CC)COc1c(Br)cc(CCC(O)=O)cc1Br
CCc1cccc(c1)-c1cc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)ccc1O
CCC(=O)Nc1ccc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)cc1Br
CC(C)C(=O)Nc1ccc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)cc1Br
CCC(C)C(=O)Nc1ccc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)cc1Br
CCCC(C)C(=O)Nc1ccc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)cc1Br
CCC(CC)C(=O)Nc1ccc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)cc1Br
CCCC(CCC)C(=O)Nc1ccc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)cc1Br
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccccc2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccccc2C(F)(F)F)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cccc(c2)C(F)(F)F)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccc(cc2)C(F)(F)F)c(Cl)c1
CC(C)c1cccc(c1)-c1cc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)ccc1O
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cccc(c2)-c2ccccc2)c(Cl)c1
COc1cccc(c1)-c1cc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)ccc1O
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cccc(OC(F)F)c2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cccc(OC(F)(F)F)c2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccccc2O)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cccc(O)c2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccc(O)cc2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccccn2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cccnc2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2ccncc2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2cncnc2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)-c2nccs2)c(Cl)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)C2CCCCC2)c(Cl)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3ccccc3)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3ccccc3C(F)(F)F)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3cccc(c3)C(F)(F)F)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3ccc(cc3)C(F)(F)F)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3cccc(c3)-c3ccccc3)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3ccccc3O)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3cccc(O)c3)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Oc3ccc(O)cc3)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)Nc2ccccc2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NCc2ccccc2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NCCc2ccccc2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NCCCc2ccccc2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NCCCCc2ccccc2)c(Br)c1
COc1ccc(CCNC(=O)c2cc(Oc3c(Br)cc(CC(O)=O)cc3Br)ccc2O)cc1
COc1cccc(CCNC(=O)c2cc(Oc3c(Br)cc(CC(O)=O)cc3Br)ccc2O)c1
COc1ccccc1CCNC(=O)c1cc(Oc2c(Br)cc(CC(O)=O)cc2Br)ccc1O
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NCC(c2ccccc2)c2ccccc2)c(Br)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NCCc2ccccn2)c(Br)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)C(=O)NCCc2ccccc2)c(Cl)c1
CCCCc1c(c2ccccc2o1)C(=O)c3cc(c(c(c3)I)OCCN(CC)CC)I
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCNCC)c(I)c1
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCCN)c(I)c1
CCCCc1oc2ccccc2c1C(=O)c1ccc(OCCN(CC)CC)c(I)c1
CCCCc1oc2ccccc2c1C(=O)c1ccc(OCCN(CC)CC)cc1
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(O)c(I)c1
CCCCc1oc2ccccc2c1C(=O)c1ccc(O)c(I)c1
CCCCc1oc2ccccc2c1C(=O)c1ccc(O)cc1
CC(C)c1cc(Oc2c(I)cc(Cc3[nH]c(=O)[nH]c3O)cc2I)ccc1O
CC(C)c1cc(Oc2c(C)cc(Cc3[nH]c(=O)[nH]c3O)cc2C)ccc1O
Cc1cc(cc(c1Cc2ccc(c(c2)C(C)C)O)C)OCC(=O)O
CC(C)c1cc(Oc2c(C)cc(C[C@H](N)C(O)=O)cc2C)ccc1O
CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)CCO[C@H]1CCC2C(C1)C[C@@H](O)C1C3CCC(C(C)CCC(O)=O)C3[C@@H](O)CC21 |r,c:18,t:11|
CC#C[C@@]1(CC[C@@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)c5ccc(cc5)N(C)C)C)O
CC(C)c1cc(OC2C(Cl)=CC(n3nc(C#N)c(=O)[nH]c3=O)=CC2Cl)n[nH]c1=O
N#CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(C4CC4)=C3)c(Cl)c2)C(=O)CC1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCOCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2ccc(Oc3cc(C4CC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Br)c(Oc3cc(C4CC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CC(F)(F)C4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C4CC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Br)c(Oc3cc(C4CCC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Br)c(Oc3cc(C4CCC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(C4CC(O)C4)=C3)c(Cl)c2)C(=O)CC1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
CC(=O)N1CCC(C2=CC(Oc3c(Cl)cc(N4N=C(C#N)C(=O)CC4=O)cc3Cl)=NCC2=O)CC1
N#Cc1nn(-c2cc(Br)c(Oc3cc(C4CCCC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
CC1(O)CC(C2=CC(Oc3c(Cl)cc(N4N=C(C#N)C(=O)CC4=O)cc3Cl)=NCC2=O)C1
Cc1nn(-c2cc(Br)c(Oc3cc(C4CCCC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Br)c(Oc3cc(C4CC4)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(-c4ccccc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(Cc4ccccc4)=C3)c(Cl)c2)C(=O)CC1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(CCc4ccccc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(Cc4ccccc4)=C3)c(Cl)c2)C(=O)CC1=O
N#CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(Cc4ccc(C#N)cc4)=C3)c(Cl)c2)C(=O)CC1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccc(Br)cc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccc(F)cc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(CCc4ccc(F)cc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
COc4ccc(Cc3cc(Oc2c(Cl)cc(n1nc(C#N)c(=O)[nH]c1=O)cc2Cl)n[nH]c3=O)cc4
N#CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(Cc4ccc(O)cc4)=C3)c(Cl)c2)C(=O)CC1=O
N#CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(Cc4cccc(O)c4)=C3)c(Cl)c2)C(=O)CC1=O
CC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(C(C)C)=C3)c(Cl)c2)C(=O)CC1=O
CC(C)C1=CC(Oc2c(Cl)cc(N3N=C(C4CC4)C(=O)CC3=O)cc2Cl)=NCC1=O
CCC1=NN(c2cc(Cl)c(OC3=NCC(=O)C(C(C)C)=C3)c(Cl)c2)C(=O)CC1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(C(C)C)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)C1=CC(Oc2c(Cl)cc(N3N=C(C(=O)O)C(=O)CC3=O)cc2Cl)=NCC1=O
CCC(CC)C1=CC(Oc2c(Cl)cc(N3N=C(C)C(=O)CC3=O)cc2Cl)=NCC1=O
Cc1c(N2N=C(C#N)C(=O)CC2=O)cc(Cl)c(OC2=NCC(=O)C(C(C)C)=C2)c1Cl
CC(C)C1=CC(Oc2c(F)cc(N3N=C(C#N)C(=O)CC3=O)cc2Cl)=NCC1=O
CC(C)C1=CC(Oc2c(F)cc(N3N=C(C#N)C(=O)CC3=O)cc2F)=NCC1=O
CC(C)C1=CC(Oc2c(Cl)cc(N3N=C(C#N)C(=O)CC3=O)c(F)c2Cl)=NCC1=O
CC(=O)Nc1cc(C)c(Oc2cc(C(C)C)c(Cl)nn2)c(C)c1F
Cc1nn(-c2cc(Br)c(Oc3cc(C(C)C)c(=O)[nH]n3)c(Br)c2)c(=O)[nH]c1=O
CC(=O)Cc1cc(Cl)c(Oc2cc(C(C)C)c(Cl)nn2)c(C(F)(F)F)c1
Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccc(F)cc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccc(Cl)cc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCC(O)CC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCC(O)C4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
COc1ccccc1Cc1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccc(O)cc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCOCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCC(O)CC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1ccc(S(=O)(=O)n2cc(C(C)C)c3cc(Oc4c(Cl)cc(N5N=C(C#N)C(=O)CC5=O)cc4Cl)ccc32)cc1
N#Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccccc4O)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Clc1ccc(Cl)nn1
Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(CC4CCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C(C)C4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCC4)c(=O)[nH]n3)c(C(F)(F)F)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCCC4)c(=O)[nH]n3)c(C(F)(F)F)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccccc4)c(=O)[nH]n3)c(C(F)(F)F)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CC4)c(=O)[nH]n3)c(C(F)(F)F)c2)c(=O)[nH]c1=O
N#Cc1ccc(Cc2cc(Oc3c(Cl)cc(-n4nc(C)c(=O)[nH]c4=O)cc3Cl)n[nH]c2=O)cc1
N#Cc1nn(-c2cc(Cl)c(Oc3ccc4[nH]cc(C5CCOCC5)c4c3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4cccc(F)c4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
COc1ccccc1Cc1cc(Oc2c(Cl)cc(-n3nc(C)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CCOP(=O)(CCc1cc(Cl)c(OC2=NCC(=O)C(C(C)C)=C2)c(Cl)c1)OCC
Cc1nn(-c2cc(Cl)c(Oc3cc([C@@H](C)c4ccccc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc([C@H](C)c4ccccc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccc5[nH]ncc5c4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4ccccn4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C(C)C4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3cc(C(C)C4CCCCC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(C4CCN(Cc5ccccc5)CC4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1cc(Cc2cc(Oc3c(Cl)cc(-n4nc(C#N)c(=O)[nH]c4=O)cc3Cl)n[nH]c2=O)on1
N#Cc1nn(-c2cc(Cl)c(Sc3cc(Cc4ccccc4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
N#Cc1nn(-c2cc(Cl)c(Oc3cc(Cc4cn[nH]c4)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
Cc1nn(-c2cc(Cl)c(Oc3ccc4[nH]cc(C(C)C)c4c3)c(Cl)c2)c(=O)[nH]c1=O
CC(C)c1c[nH]c2ccc(Oc3c(Cl)cc(-n4nc(C#N)c(=O)[nH]c4=O)cc3C(F)(F)F)cc12
Cc1ccc(S(=O)(=O)n2cc(C(C)C)c3cc(Oc4c(Cl)cc(-n5nc(C#N)c(=O)[nH]c5=O)cc4Cl)cnc32)cc1
Cc1cc(OCP(=O)(O)O)cc(C)c1Cc1cc(C(C)C)c(=O)[nH]n1
CC(O)(CO)c1ccc(Cc2cc(Oc3c(Cl)cc(-n4nc(C#N)c(=O)[nH]c4=O)cc3Cl)n[nH]c2=O)cc1
N#Cc1nn(-c2cc(Cl)c(Oc3ccc4[nH]cc(C(N)=O)c4c3)c(Cl)c2)c(=O)[nH]c1=O
CC(c1ccccc1)c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(c1ccccc1)c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1nn(-c2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)c2ccc(O)cc12
CC(C)c1nn(-c2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)c2ccc(O)cc12
CC(c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O)C1CCCCC1
CC(c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O)C1CCCCC1
CC(c1ccccc1)c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2C(F)(F)F)n[nH]c1=O
CC(c1ccccc1)c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2C(F)(F)F)n[nH]c1=O
CC(c1ccccc1)c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2C(F)(F)F)n[nH]c1=O
CC(c1cc(Oc2c(Cl)cc(-n3nc(C#N)c(=O)[nH]c3=O)cc2C(F)(F)F)n[nH]c1=O)C1CCCCC1
CC(C)c1cc(Cc2c(Br)cc(OCC(O)=O)cc2Br)ccc1O
CC(C)c1cc(Cc2c(Cl)cc(OCC(O)=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NCc3noc(=O)[nH]3)cc2Cl)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)N(C)Cc2noc(=O)[nH]2)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(N[C@@H](C)c3noc(=O)[nH]3)cc2Cl)nn(C)c1=O |r|
CC(C)c1cc(Oc2c(Cl)cc(N[C@H](C)c3noc(=O)[nH]3)cc2Cl)nn(C)c1=O |r|
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(NCc3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(OCc3noc(=O)[nH]3)cc2Cl)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)-c2cc(=O)[nH]o2)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)-c2cc(=O)[nH]o2)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)-c2noc(=O)[nH]2)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)c(C)c2Cl)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(NCc3noc(=O)[nH]3)c(C)c2Cl)nn(C)c1=O
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
CC(C)c1cc(nn(C)c1=O)C(=O)c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl
CC(C)c1cc(nn(C)c1=O)C(=O)c1c(Cl)cc(NCc2noc(=O)[nH]2)cc1Cl
CC(C)c1cc(nn(C)c1=O)S(=O)(=O)c1c(Cl)cc(NCc2noc(=O)[nH]2)cc1Cl
CC(C)c1cc(nn(C)c1=O)S(=O)(=O)c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl
Clc1cc(NC(=O)c2noc(=O)[nH]2)cc(Cl)c1Cc1cc(C2CC2)c(=O)[nH]n1
Cn1nc(Cc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)cc(C2CC2)c1=O
CC(C)c1cc(Oc2c3CCCc3c(NC(=O)c3noc(=O)[nH]3)cc2Cl)nn(C)c1=O
Clc1cc(NC(=O)c2noc(=O)[nH]2)cc(Cl)c1Oc1cc(C2CC2)c(=O)[nH]n1
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)c(F)c2Cl)nn(C)c1=O
CC(C)(C)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
CC(O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
C[C@@H](O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O |r|
C[C@H](O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O |r|
CC(C)c1cc(Oc2c(C)cc(NC(=O)c3noc(=O)[nH]3)cc2C)n[nH]c1=O
Clc1cc(NC(=O)c2noc(=O)[nH]2)cc(Cl)c1Oc1cc(c(=O)[nH]n1)C12CC(C1)C2
CCC(O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
CC[C@@H](O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O |r|
CC[C@H](O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O |r|
CC(C)(O)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)c(F)c2Cl)n[nH]c1=O
CC(CO)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)nn(C)c1=O
CC(CO)c1cc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)n[nH]c1=O
Cn1nc(Oc2c(Cl)cc(NC(=O)c3noc(=O)[nH]3)cc2Cl)cc(c1=O)C(C)(C)O
CCOc1ccc(cc1CC(O)=O)-c1cccc(CCCc2nn(Cc3ccc(cc3)C(C)(C)C)c(=O)n2CC)c1
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)-n2nc(C#N)c(=O)[nH]c2=O)n[nH]c1=O
COc1ccc2n(ccc2c1)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.83,-5.74,;-5.51,-6.52,;-4.19,-5.74,;-4.19,-4.19,;-2.87,-3.49,;-1.55,-4.19,;-.08,-3.72,;.85,-4.97,;-.08,-6.21,;-1.55,-5.74,;-2.87,-6.52,;.39,-2.25,;-.62,-1.16,;-2.09,-1.47,;-.16,.31,;1.4,.62,;2.41,-.54,;1.94,-1.94,;2.95,-3.1,;1.86,2.09,;3.34,2.41,;3.8,3.88,;5.28,4.19,;6.83,4.5,;2.79,5.04,;3.26,6.52,;1.24,4.73,;.78,3.26,;-.7,2.95,)|
Oc1ccc2n(ccc2c1)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.17,-6.52,;-4.85,-5.74,;-4.85,-4.19,;-3.53,-3.49,;-2.21,-4.19,;-.74,-3.72,;.19,-4.97,;-.74,-6.21,;-2.21,-5.74,;-3.53,-6.52,;-.27,-2.25,;-1.28,-1.16,;-2.75,-1.47,;-.81,.31,;.74,.62,;1.75,-.54,;1.28,-1.94,;2.29,-3.1,;1.2,2.09,;2.68,2.41,;3.14,3.88,;4.62,4.19,;6.17,4.5,;2.13,5.04,;2.6,6.52,;.66,4.73,;.12,3.26,;-1.36,2.95,)|
Oc1ccc2n(ncc2c1)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.13,-10.91,;-4.8,-11.68,;-4.8,-13.22,;-3.46,-13.99,;-2.13,-13.22,;-.67,-13.7,;.24,-12.45,;-.67,-11.2,;-2.13,-11.68,;-3.46,-10.91,;-.19,-15.16,;1.32,-15.48,;2.35,-14.34,;1.79,-16.95,;.76,-18.09,;-.74,-17.77,;-1.22,-16.3,;-2.73,-15.98,;1.24,-19.55,;2.74,-19.87,;3.27,-21.35,;4.78,-21.67,;6.29,-21.99,;2.19,-22.48,;2.67,-23.95,;.68,-22.16,;.21,-20.7,;-1.3,-20.38,)|
Oc1ccc2N(CCc2c1)c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O
CC(C)c1cc2n(ccc2cc1O)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.85,3.49,;-5.52,2.72,;-5.52,1.18,;-4.18,3.49,;-2.85,2.72,;-1.51,3.49,;-.05,3.02,;.86,4.26,;-.05,5.51,;-1.51,5.03,;-2.85,5.8,;-4.18,5.03,;-5.52,5.8,;.43,1.55,;1.93,1.23,;2.96,2.38,;2.41,-.23,;1.38,-1.38,;-.13,-1.06,;-.6,.41,;-2.11,.73,;1.85,-2.84,;3.36,-3.16,;3.89,-4.64,;5.4,-4.96,;6.9,-5.28,;2.81,-5.77,;3.28,-7.23,;1.3,-5.45,;.82,-3.99,;-.68,-3.66,)|
Oc1ccc2n(cnc2c1)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.13,-10.91,;-4.8,-11.68,;-4.8,-13.22,;-3.46,-13.99,;-2.13,-13.22,;-.67,-13.7,;.24,-12.45,;-.67,-11.2,;-2.13,-11.68,;-3.46,-10.91,;-.19,-15.16,;1.32,-15.48,;2.35,-14.34,;1.79,-16.95,;.76,-18.09,;-.74,-17.77,;-1.22,-16.3,;-2.73,-15.98,;1.24,-19.55,;2.74,-19.87,;3.27,-21.35,;4.78,-21.67,;6.29,-21.99,;2.19,-22.48,;2.67,-23.95,;.68,-22.16,;.21,-20.7,;-1.3,-20.38,)|
Oc1ccc2n(ccc2c1)-c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl |(-6.79,23.95,;-5.45,23.18,;-5.45,21.64,;-4.12,20.87,;-2.78,21.64,;-1.32,21.16,;-.41,22.41,;-1.32,23.65,;-2.78,23.18,;-4.12,23.95,;-.84,19.7,;.66,19.38,;1.69,20.52,;1.14,17.91,;.11,16.77,;.58,15.3,;2.09,14.98,;2.57,13.52,;3.12,16.13,;2.8,17.63,;4.13,18.4,;5.28,17.37,;6.79,17.69,;4.65,15.97,;-1.4,17.09,;-1.87,18.55,;-3.38,18.87,)|
Oc1ccc2n(cc(Br)c2c1)-c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl |(-6.79,5.3,;-5.45,4.53,;-5.45,2.99,;-4.12,2.22,;-2.78,2.99,;-1.32,2.52,;-.41,3.76,;-1.32,5.01,;-.84,6.47,;-2.78,4.53,;-4.12,5.3,;-.84,1.05,;.66,.73,;1.69,1.88,;1.14,-.73,;.11,-1.88,;.58,-3.34,;2.09,-3.66,;2.57,-5.13,;3.12,-2.52,;2.8,-1.01,;4.13,-.24,;5.28,-1.27,;6.79,-.95,;4.65,-2.68,;-1.4,-1.56,;-1.87,-.09,;-3.38,.23,)|
Cc1cc2n(ccc2cc1O)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.14,-3.4,;-4.83,-4.17,;-3.52,-3.4,;-2.13,-4.17,;-.73,-3.71,;.19,-4.95,;-.73,-6.18,;-2.13,-5.72,;-3.52,-6.49,;-4.83,-5.72,;-6.14,-6.49,;-.19,-2.24,;-1.28,-1.08,;-2.74,-1.39,;-.81,.39,;.73,.7,;1.74,-.46,;1.28,-1.93,;2.28,-3.09,;1.2,2.16,;2.67,2.47,;3.13,3.86,;4.68,4.25,;6.13,4.62,;2.13,5.02,;2.59,6.49,;.66,4.71,;.19,3.25,;-1.35,2.94,)|
Cc1cc2n(ncc2cc1O)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.18,21.21,;-4.85,21.98,;-3.51,21.21,;-2.18,21.98,;-.72,21.5,;.19,22.75,;-.72,23.99,;-2.18,23.52,;-3.51,24.29,;-4.85,23.52,;-6.18,24.29,;-.24,20.04,;1.27,19.72,;2.3,20.86,;1.74,18.25,;.71,17.11,;-.8,17.43,;-1.27,18.89,;-2.78,19.21,;1.19,15.64,;2.69,15.32,;3.22,13.85,;4.73,13.53,;6.24,13.21,;2.14,12.71,;2.61,11.25,;.63,13.03,;.16,14.5,;-1.35,14.82,)|
Cc1c(O)ccc2n(ccc12)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-3.47,-7.3,;-3.47,-5.82,;-4.8,-5.04,;-6.21,-5.82,;-4.8,-3.47,;-3.47,-2.69,;-2.15,-3.47,;-.66,-3.01,;.2,-4.26,;-.66,-5.5,;-2.15,-5.04,;-.2,-1.52,;-1.21,-.35,;-2.77,-.66,;-.74,1.13,;.74,1.44,;1.76,.27,;1.29,-1.21,;2.3,-2.38,;1.21,2.85,;2.77,3.24,;3.24,4.65,;4.72,5.04,;6.19,5.42,;2.15,5.82,;2.62,7.3,;.66,5.5,;.2,4.02,;-1.29,3.71,)|
Cc1c(O)ccc2n(ncc12)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-3.51,-9.71,;-3.51,-11.25,;-4.85,-12.02,;-6.18,-11.25,;-4.85,-13.56,;-3.51,-14.33,;-2.18,-13.56,;-.72,-14.04,;.19,-12.79,;-.72,-11.54,;-2.18,-12.02,;-.24,-15.5,;1.27,-15.82,;2.3,-14.68,;1.74,-17.29,;.71,-18.43,;-.8,-18.11,;-1.27,-16.64,;-2.78,-16.32,;1.19,-19.89,;2.69,-20.21,;3.22,-21.69,;4.73,-22.01,;6.24,-22.33,;2.14,-22.82,;2.61,-24.29,;.63,-22.5,;.16,-21.04,;-1.35,-20.72,)|
Cc1cn(-c2c(Cl)cc(cc2Cl)-n2nc(C#N)c(=O)[nH]c2=O)c2ccc(O)cc12 |(-.84,24.25,;-1.32,22.79,;-.41,21.54,;-1.32,20.29,;-.84,18.83,;.66,18.51,;1.69,19.65,;1.14,17.05,;.11,15.9,;-1.4,16.22,;-1.87,17.69,;-3.38,18.01,;.58,14.44,;2.09,14.12,;2.62,12.64,;4.13,12.32,;5.63,12,;1.54,11.51,;2.01,10.04,;.03,11.83,;-.45,13.29,;-1.95,13.61,;-2.78,20.77,;-4.12,20,;-5.45,20.77,;-5.45,22.31,;-6.79,23.08,;-4.12,23.08,;-2.78,22.31,)|
Cc1c(O)ccc2n(ncc12)-c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl |(-4.12,6.3,;-4.12,4.76,;-5.45,3.99,;-6.79,4.76,;-5.45,2.45,;-4.12,1.68,;-2.78,2.45,;-1.32,1.97,;-.41,3.22,;-1.32,4.47,;-2.78,3.99,;-.84,.51,;.66,.19,;1.69,1.33,;1.14,-1.28,;.11,-2.42,;.58,-3.89,;2.09,-4.21,;2.57,-5.67,;3.12,-3.06,;2.8,-1.55,;4.13,-.78,;5.28,-1.81,;6.79,-1.49,;4.65,-3.22,;-1.4,-2.1,;-1.87,-.64,;-3.38,-.32,)|
Cc1c(O)ccc2n(cc(Br)c12)-c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl |(-4.12,-12.28,;-4.12,-13.82,;-5.45,-14.59,;-6.79,-13.82,;-5.45,-16.13,;-4.12,-16.9,;-2.78,-16.13,;-1.32,-16.61,;-.41,-15.36,;-1.32,-14.12,;-.84,-12.65,;-2.78,-14.59,;-.84,-18.07,;.66,-18.39,;1.69,-17.25,;1.14,-19.86,;.11,-21,;.58,-22.47,;2.09,-22.79,;2.57,-24.25,;3.12,-21.64,;2.8,-20.14,;4.13,-19.37,;5.28,-20.4,;6.79,-20.08,;4.65,-21.8,;-1.4,-20.68,;-1.87,-19.22,;-3.38,-18.9,)|
Clc1cc(cc(Cl)c1-n1ccc2[nH]c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(-2.74,-1.43,;-1.28,-1.12,;-.81,.35,;.66,.66,;1.74,-.5,;1.28,-1.97,;2.28,-3.05,;-.27,-2.28,;-.73,-3.75,;.19,-4.99,;-.73,-6.22,;-2.2,-5.76,;-3.52,-6.45,;-4.83,-5.76,;-6.14,-6.45,;-4.83,-4.21,;-3.52,-3.44,;-2.2,-4.21,;1.2,2.13,;2.67,2.43,;3.13,3.9,;4.6,4.21,;6.14,4.52,;2.13,4.99,;2.59,6.45,;.58,4.68,;.12,3.21,;-1.35,2.9,)|
COc1ccc2n(ccc2n1)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.85,6.46,;-5.52,7.23,;-4.18,6.46,;-4.18,4.92,;-2.85,4.15,;-1.51,4.92,;-.05,4.45,;.86,5.69,;-.05,6.94,;-1.51,6.46,;-2.85,7.23,;.43,2.98,;1.93,2.66,;2.96,3.81,;2.41,1.2,;1.38,.05,;-.13,.37,;-.6,1.84,;-2.11,2.16,;1.85,-1.41,;3.36,-1.73,;3.89,-3.21,;5.4,-3.53,;6.9,-3.85,;2.81,-4.34,;3.28,-5.8,;1.3,-4.02,;.82,-2.56,;-.68,-2.23,)|
CC(C)c1cn(-c2c(Cl)cc(cc2Cl)-n2nc(C#N)c(=O)[nH]c2=O)c2ccc(O)cc12 |(1.32,-11.03,;-.19,-11.35,;-1.22,-10.2,;-.67,-12.81,;.24,-14.06,;-.67,-15.3,;-.19,-16.77,;1.32,-17.09,;2.35,-15.94,;1.79,-18.55,;.76,-19.7,;-.74,-19.38,;-1.22,-17.91,;-2.73,-17.59,;1.24,-21.16,;2.74,-21.48,;3.27,-22.96,;4.78,-23.28,;6.29,-23.6,;2.19,-24.09,;2.67,-25.56,;.68,-23.77,;.21,-22.31,;-1.3,-21.99,;-2.13,-14.83,;-3.46,-15.6,;-4.8,-14.83,;-4.8,-13.29,;-6.13,-12.52,;-3.46,-12.52,;-2.13,-13.29,)|
Cn1c2ccn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2ccc1=O |(-3.52,-7.24,;-3.52,-5.69,;-2.13,-4.92,;-.74,-5.46,;.19,-4.22,;-.74,-2.98,;-.27,-1.51,;-1.28,-.35,;-2.75,-.66,;-.81,1.12,;.74,1.43,;1.74,.27,;1.28,-1.2,;2.28,-2.28,;1.2,2.9,;2.67,3.21,;3.14,4.69,;4.69,5,;6.16,5.31,;2.13,5.77,;2.59,7.24,;.66,5.46,;.19,3.99,;-1.36,3.68,;-2.13,-3.45,;-3.52,-2.67,;-4.84,-3.45,;-4.84,-4.92,;-6.16,-5.69,)|
CC(C)n1c2ccn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2ccc1=O |(-2.13,-7.64,;-3.53,-6.87,;-4.85,-7.64,;-3.53,-5.31,;-2.13,-4.54,;-.74,-5.08,;.19,-3.76,;-.74,-2.52,;-.27,-1.12,;-1.28,.04,;-2.75,-.27,;-.81,1.51,;.74,1.82,;1.75,.66,;1.28,-.81,;2.29,-1.9,;1.2,3.3,;2.68,3.61,;3.14,5.08,;4.69,5.39,;6.17,5.7,;2.13,6.25,;2.6,7.64,;.66,5.86,;.19,4.46,;-1.36,4.07,;-2.13,-3.06,;-3.53,-2.29,;-4.85,-3.06,;-4.85,-4.54,;-6.17,-5.31,)|
Cc1c(O)ccc2n(ccc12)-c1c(Cl)cc(NC(=O)c2noc(=O)[nH]2)cc1Cl |(-3.87,-13.22,;-3.87,-14.76,;-5.21,-15.53,;-6.54,-14.76,;-5.21,-17.07,;-3.87,-17.84,;-2.54,-17.07,;-1.08,-17.55,;-.17,-16.3,;-1.08,-15.06,;-2.54,-15.53,;-.6,-19.02,;.91,-19.34,;1.94,-18.19,;1.38,-20.8,;.35,-21.94,;.83,-23.41,;2.33,-23.73,;2.81,-25.19,;3.36,-22.58,;3.04,-21.08,;4.38,-20.31,;5.52,-21.34,;7.03,-21.02,;4.9,-22.75,;-1.15,-21.62,;-1.63,-20.16,;-3.14,-19.84,)|
Oc1cnc2n(ccc2c1)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-6.3,25.73,;-4.96,24.96,;-4.96,23.42,;-3.63,22.65,;-2.3,23.42,;-.83,22.94,;.07,24.19,;-.83,25.43,;-2.3,24.96,;-3.63,25.73,;-.36,21.48,;1.15,21.16,;2.18,22.3,;1.63,19.69,;.6,18.55,;-.91,18.87,;-1.39,20.33,;-2.89,20.65,;1.07,17.08,;.04,15.94,;.48,14.43,;-.55,13.29,;-1.58,12.15,;2.02,14.15,;2.5,12.69,;3.05,15.3,;2.58,16.76,;3.61,17.91,)|
CC(C)n1c2ccn(-c3c(Cl)cc(NC(=O)c4noc(=O)[nH]4)cc3Cl)c2ccc1=O |(-2.78,-6.34,;-4.1,-5.57,;-5.49,-6.34,;-4.1,-4.1,;-2.78,-3.32,;-1.31,-3.79,;-.46,-2.55,;-1.31,-1.31,;-.85,.15,;-1.93,1.31,;-3.4,1,;-1.39,2.78,;.08,3.09,;.54,4.48,;2.01,4.87,;2.47,6.34,;3.09,3.79,;2.86,2.24,;4.25,1.55,;5.33,2.63,;6.8,2.4,;4.64,4.02,;1.08,1.93,;.62,.46,;1.62,-.7,;-2.78,-1.78,;-4.1,-1,;-5.49,-1.78,;-5.49,-3.32,;-6.8,-4.1,)|
Clc1cc(cc(Cl)c1-n1ccc2n(C3CC3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(-2.76,-.04,;-1.28,.27,;-.74,1.75,;.74,2.06,;1.75,.97,;1.28,-.5,;2.29,-1.67,;-.19,-.82,;-.66,-2.29,;.19,-3.53,;-.66,-4.78,;-2.14,-4.31,;-3.46,-5.09,;-3.46,-6.64,;-2.68,-7.96,;-4.23,-7.96,;-4.86,-4.31,;-6.18,-5.09,;-4.86,-2.76,;-3.46,-1.98,;-2.14,-2.76,;1.2,3.53,;2.68,3.85,;3.22,5.32,;4.7,5.63,;6.18,5.94,;2.14,6.49,;2.6,7.96,;.66,6.18,;.19,4.7,;-1.36,4.39,)|
Clc1cc(NC(=O)c2noc(=O)[nH]2)cc(Cl)c1-n1ccc2n(C3CC3)c(=O)ccc12 |(1.69,17.89,;.66,16.75,;1.14,15.28,;.11,14.14,;.58,12.67,;2.09,12.35,;2.57,10.89,;3.12,13.5,;2.8,15.01,;4.13,15.78,;5.28,14.74,;6.79,15.07,;4.65,13.34,;-1.4,14.46,;-1.87,15.92,;-3.38,16.24,;-.84,17.07,;-1.32,18.53,;-.41,19.78,;-1.32,21.03,;-2.78,20.55,;-4.12,21.32,;-4.12,22.86,;-3.35,24.19,;-4.89,24.19,;-5.45,20.55,;-6.79,21.32,;-5.45,19.01,;-4.12,18.24,;-2.78,19.01,)|
CC(C)n1c2cnn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2ccc1=O |(-2.78,7.91,;-4.12,7.14,;-5.45,7.91,;-4.12,5.6,;-2.78,4.83,;-1.32,5.3,;-.41,4.06,;-1.32,2.81,;-.84,1.35,;.66,1.03,;1.69,2.17,;1.14,-.44,;.11,-1.58,;-1.4,-1.26,;-1.87,.2,;-3.38,.52,;.58,-3.05,;2.09,-3.37,;2.62,-4.84,;4.13,-5.16,;5.63,-5.48,;1.54,-5.98,;2.01,-7.44,;.03,-5.66,;-.45,-4.19,;-1.95,-3.87,;-2.78,3.29,;-4.12,2.52,;-5.45,3.29,;-5.45,4.83,;-6.79,5.6,)|
CC(C)n1c2cnn(-c3c(Cl)cc(NC(=O)c4noc(=O)[nH]4)cc3Cl)c2ccc1=O |(-5.45,-11.45,;-4.12,-12.22,;-2.78,-11.45,;-4.12,-13.76,;-2.78,-14.53,;-1.32,-14.06,;-.41,-15.3,;-1.32,-16.55,;-.84,-18.01,;.66,-18.33,;1.69,-17.19,;1.14,-19.8,;.11,-20.94,;.58,-22.41,;2.09,-22.73,;2.57,-24.19,;3.12,-21.58,;2.8,-20.08,;4.13,-19.31,;5.28,-20.34,;6.79,-20.02,;4.65,-21.74,;-1.4,-20.62,;-1.87,-19.16,;-3.38,-18.84,;-2.78,-16.07,;-4.12,-16.84,;-5.45,-16.07,;-5.45,-14.53,;-6.79,-13.76,)|
Clc1cc(cc(Cl)c1-n1ncc2n(C3CCCCC3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(1.69,19.59,;.66,18.45,;1.14,16.98,;.11,15.84,;-1.4,16.16,;-1.87,17.62,;-3.38,17.94,;-.84,18.77,;-1.32,20.23,;-.41,21.48,;-1.32,22.72,;-2.78,22.25,;-4.12,23.02,;-4.12,24.56,;-2.78,25.33,;-2.78,26.87,;-4.12,27.64,;-5.45,26.87,;-5.45,25.33,;-5.45,22.25,;-6.79,23.02,;-5.45,20.71,;-4.12,19.94,;-2.78,20.71,;.58,14.37,;2.09,14.05,;2.62,12.58,;4.13,12.26,;5.63,11.94,;1.54,11.44,;2.01,9.98,;.03,11.76,;-.45,13.23,;-1.95,13.55,)|
Clc1cc(NC(=O)c2noc(=O)[nH]2)cc(Cl)c1-n1ccc2n(C3CCOCC3)c(=O)ccc12 |(1.69,-.22,;.66,-1.37,;1.14,-2.83,;.11,-3.98,;.58,-5.44,;2.09,-5.76,;2.57,-7.23,;3.12,-4.62,;2.8,-3.11,;4.13,-2.34,;5.28,-3.37,;6.79,-3.05,;4.65,-4.78,;-1.4,-3.66,;-1.87,-2.19,;-3.38,-1.87,;-.84,-1.05,;-1.32,.42,;-.41,1.66,;-1.32,2.91,;-2.78,2.43,;-4.12,3.2,;-4.12,4.74,;-2.78,5.51,;-2.78,7.05,;-4.12,7.82,;-5.45,7.05,;-5.45,5.51,;-5.45,2.43,;-6.79,3.2,;-5.45,.89,;-4.12,.12,;-2.78,.89,)|
Clc1cc(NC(=O)c2noc(=O)[nH]2)cc(Cl)c1-n1ccc2n(C3CCCC3)c(=O)ccc12 |(1.69,-17.87,;.66,-19.02,;1.14,-20.48,;.11,-21.63,;.58,-23.09,;2.09,-23.41,;2.57,-24.88,;3.12,-22.27,;2.8,-20.76,;4.13,-19.99,;5.28,-21.02,;6.79,-20.7,;4.65,-22.43,;-1.4,-21.31,;-1.87,-19.84,;-3.38,-19.52,;-.84,-18.7,;-1.32,-17.23,;-.41,-15.99,;-1.32,-14.74,;-2.78,-15.22,;-4.12,-14.45,;-4.12,-12.91,;-2.87,-12,;-3.35,-10.54,;-4.89,-10.54,;-5.36,-12,;-5.45,-15.22,;-6.79,-14.45,;-5.45,-16.76,;-4.12,-17.53,;-2.78,-16.76,)|
CC(C)n1c2ccn(-c3c(Cl)cc(cc3Cl)-c3c[nH]c(=O)[nH]c3=O)c2ccc1=O |(-2.78,9.61,;-4.12,8.84,;-5.45,9.61,;-4.12,7.3,;-2.78,6.53,;-1.32,7.01,;-.41,5.76,;-1.32,4.52,;-.84,3.05,;.66,2.73,;1.69,3.88,;1.14,1.27,;.11,.12,;-1.4,.45,;-1.87,1.91,;-3.38,2.23,;.58,-1.34,;-.45,-2.48,;.03,-3.95,;1.54,-4.27,;2.01,-5.73,;2.57,-3.12,;2.09,-1.66,;3.12,-.52,;-2.78,4.99,;-4.12,4.22,;-5.45,4.99,;-5.45,6.53,;-6.79,7.3,)|
CC(C)n1c2ccn(-c3c(Cl)cc(cc3Cl)-c3nn(C)c(=O)[nH]c3=O)c2ccc1=O |(-1.4,-7.64,;-2.79,-6.87,;-4.11,-7.64,;-2.79,-5.31,;-1.4,-4.54,;,-5.08,;.93,-3.76,;,-2.52,;.54,-1.12,;-.54,.04,;-2.02,-.27,;-.08,1.51,;1.47,1.82,;2.48,.66,;2.02,-.81,;3.03,-1.9,;1.94,3.3,;3.41,3.61,;3.88,5.08,;5.43,5.39,;2.87,6.24,;3.34,7.64,;1.4,5.86,;.93,4.46,;-.62,4.07,;-1.4,-3.06,;-2.79,-2.29,;-4.11,-3.06,;-4.11,-4.54,;-5.43,-5.31,)|
Clc1cc(cc(Cl)c1-n1ncc2n(Cc3ccccc3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(4.19,-1.19,;3.16,-.05,;3.64,1.42,;2.61,2.56,;1.1,2.24,;.62,.78,;-.88,.46,;1.66,-.37,;1.18,-1.83,;2.08,-3.08,;1.18,-4.33,;-.29,-3.85,;-1.62,-4.62,;-1.62,-6.16,;-2.95,-6.93,;-4.29,-6.16,;-5.62,-6.93,;-5.62,-8.47,;-4.29,-9.24,;-2.95,-8.47,;-2.95,-3.85,;-4.29,-4.62,;-2.95,-2.31,;-1.62,-1.54,;-.29,-2.31,;3.08,4.02,;2.05,5.17,;2.49,6.67,;1.46,7.82,;.43,8.96,;4.03,6.95,;4.51,8.42,;5.07,5.81,;4.59,4.34,;5.62,3.2,)|
Clc1cc(cc(Cl)c1-n1ncc2n(C3CC3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(3.08,-24,;2.05,-22.85,;2.52,-21.39,;1.49,-20.24,;-.01,-20.56,;-.49,-22.03,;-2,-22.35,;.54,-23.17,;.06,-24.64,;.97,-25.88,;.06,-27.13,;-1.4,-26.65,;-2.73,-27.42,;-2.73,-28.96,;-3.5,-30.3,;-1.96,-30.3,;-4.07,-26.65,;-5.4,-27.42,;-4.07,-25.11,;-2.73,-24.34,;-1.4,-25.11,;1.97,-18.78,;.94,-17.63,;1.38,-16.13,;.35,-14.99,;-.69,-13.84,;2.92,-15.85,;3.4,-14.39,;3.95,-16.99,;3.47,-18.46,;4.5,-19.6,)|
Clc1cc(cc(Cl)c1-n1ncc2n(Cc3ccccc3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(3.45,21.82,;2.42,22.97,;2.9,24.43,;1.87,25.58,;.36,25.26,;-.12,23.79,;-1.62,23.47,;.91,22.65,;.44,21.18,;1.34,19.94,;.44,18.69,;-1.03,19.17,;-2.36,18.4,;-2.36,16.86,;-3.69,16.09,;-5.03,16.86,;-6.36,16.09,;-6.36,14.55,;-5.03,13.78,;-3.69,14.55,;-3.69,19.17,;-5.03,18.4,;-3.69,20.71,;-2.36,21.48,;-1.03,20.71,;2.34,27.04,;1.31,28.19,;1.75,29.69,;.72,30.84,;-.31,31.98,;3.29,29.97,;3.77,31.44,;4.32,28.83,;3.85,27.36,;4.88,26.22,)|
Clc1cc(cc(Cl)c1-n1ncc2n(CC3CCCCC3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(2.87,-23.12,;1.84,-21.98,;2.32,-20.52,;1.29,-19.37,;-.22,-19.69,;-.7,-21.16,;-2.2,-21.48,;.33,-22.3,;-.14,-23.76,;.76,-25.01,;-.14,-26.26,;-1.61,-25.78,;-2.94,-26.55,;-2.94,-28.09,;-4.27,-28.86,;-5.61,-28.09,;-6.94,-28.86,;-6.94,-30.4,;-5.61,-31.17,;-4.27,-30.4,;-4.27,-25.78,;-5.61,-26.55,;-4.27,-24.24,;-2.94,-23.47,;-1.61,-24.24,;1.76,-17.91,;.73,-16.76,;1.17,-15.26,;.14,-14.11,;-.89,-12.97,;2.71,-14.98,;3.19,-13.51,;3.74,-16.12,;3.27,-17.59,;4.3,-18.73,)|
CC(C)Cn1c2cnn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2ccc1=O |(-5.1,-7.95,;-5.1,-6.41,;-6.44,-5.64,;-3.77,-5.64,;-3.77,-4.1,;-2.44,-3.33,;-.97,-3.81,;-.07,-2.56,;-.97,-1.32,;-.49,.15,;1.01,.47,;2.04,-.68,;1.49,1.93,;.46,3.08,;-1.05,2.76,;-1.53,1.29,;-3.03,.97,;.93,4.54,;-.1,5.68,;.34,7.19,;-.69,8.34,;-1.72,9.48,;1.88,7.47,;2.36,8.93,;2.92,6.33,;2.44,4.86,;3.47,3.72,;-2.44,-1.79,;-3.77,-1.02,;-5.1,-1.79,;-5.1,-3.33,;-6.44,-4.1,)|
Cn1c2cc(Oc3c(Cl)cc(NC(=O)c4noc(=O)[nH]4)cc3Cl)ccc2[nH]c1=O
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1C(=O)N1CC2CCC1C2
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)N1C2CCC1CC1(CCCO1)C2 |TLB:34:33:27:29.30,THB:24:27:33.38.32:29.30,37:33:27:29.30|
CCOC(=O)C(=O)Nc1cc(C)c(Oc2ccc(O)c(c2)C(O)c2ccc(F)cc2)c(C)c1
CC(C)c1cc(Oc2c(Br)cc(OCC(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(C)cc(SCC(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NCC(O)=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)C(O)=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(I)cc(NC(=O)C(O)=O)cc2I)ccc1O
CC(C)c1cc(Oc2c(Br)cc(SCC(O)=O)cc2Br)ccc1O
N[C@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O
OC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc(O)c(Cc3ccc(F)cc3)c2)c(Cl)c1
CC(C)c1cc(Oc2c(C)cc(NC(=O)C(N)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(Br)cc(C[C@H](N)C(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(I)cc(NCC(O)=O)cc2I)ccc1O
CC(C)c1cc(Oc2c(C)cc(NC(=O)C(O)=O)cc2C)ccc1O
OC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc(O)c(Cc3ccc(Cl)cc3)c2)c(Cl)c1
Cc1cc(NC(=O)C(O)=O)cc(C)c1Oc1ccc(O)c(c1)C(O)c1ccc(F)cc1
CC(C)c1cc(Oc2c(cc(NC(=O)C(O)=O)cc2C(C)C)C(C)C)ccc1O
N[C@@H](Cc1cc(Br)c(Oc2ccc(O)c(Cc3ccc(=O)[nH]n3)c2)c(Br)c1)C(O)=O
OC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc(O)c(c2)C(=O)c2ccc(F)cc2)c(Cl)c1
CC(C)c1cc(Oc2c(C)cc(NCC(O)=O)cc2C)ccc1O
Cc1cc(NC(=O)C(O)=O)cc(C)c1Oc1ccc(O)c(Cc2ccc(Cl)cc2)c1
CC(C)c1cc(Oc2c(Br)cc(NC(=O)C(N)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2ccc(NC(=O)C(O)=O)cc2)ccc1O
CC(C)c1cc(Oc2c(Br)cc(NC(=O)C(O)=O)cc2Br)ccc1O
CC(C)c1cc(n[nH]c1=O)S(=O)(=O)c1c(Cl)cc(CC(O)=O)cc1Cl
CC(C)c1cc(Oc2c(C)cc(CC(O)=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(C)cc(CC(O)=O)cc2C)n[nH]c1=O
CC(C)c1cc(n[nH]c1=O)[S+]([O-])c1c(Cl)cc(CC(O)=O)cc1Cl
CC(C)c1cc(Sc2c(Cl)cc(CC(O)=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Cc2c(Cl)cc(CC(O)=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)-n2nc(C#N)c(=O)[nH]c2=O)nn(C)c1=O
CC(C)c1cc(Cc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)C(O)=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)n[nH]c1=O
CC(C)c1cc(Cc2c(Cl)cc(cc2Cl)-n2nc(C#N)c(=O)[nH]c2=O)nn(C)c1=O
CC(C)c1cc(Cc2c(Cl)cc(cc2Cl)-n2nc(C#N)c(=O)[nH]c2=O)n[nH]c1=O
CC(C)c1cc(Oc2c(Br)cc(CC(O)=O)cc2Br)n[nH]c1=O
CC(C)c1cc(Cc2c(Br)cc(CC(O)=O)cc2Br)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(NCC(O)=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Br)cc(CCC(O)=O)cc2Br)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(CC(O)=O)cc2Cl)nn(C)c1=O
CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccccc3)cn2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O
CCn1c(CCCc2ccc(cc2)-c2ccc(NS(=O)(=O)c3ccc(cc3)-c3ccc(OC)cc3)cc2)nn(Cc2ccc(cc2)C(C)(C)C)c1=O
CC(C)c1cc(ccc1O)C(CC=C)c1c(C)cc(OCC(O)=O)cc1C
CCCCN(C)C(=O)CCCCCCCCCCC(c1ccc(O)c(c1)C(C)C)c1c(C)cc(OCC(O)=O)cc1C
CCCCN(C)C(=O)CCCCCC\C=C/CCC(c1ccc(O)c(c1)C(C)C)c1c(C)cc(OCC(O)=O)cc1C
CC(C)c1cc(ccc1O)C(CCCO)c1c(C)cc(OCC(O)=O)cc1C
COc1ccc(C(c2ccc(O)c(c2)C(C)C)c2c(C)cc(OCC(O)=O)cc2C)c(OC)c1
Cc1oc2ccccc2c1C(=O)c1cc(I)c(OCC(O)=O)c(I)c1
Cc1oc2ccccc2c1Cc1cc(I)c(OCC(O)=O)c(I)c1
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(OCC(O)=O)c(I)c1
CCCCCc1ccc(cc1)C#Cc1cc(Cc2c(C)cc(OCC(O)=O)cc2C)cc(C(C)C)c1O
CC(C)c1cc(Cc2c(C)cc(OCC(O)=O)cc2C)cc(C#Cc2ccccc2)c1O
CC(C)c1cc(Cc2c(C)cc(OCC(O)=O)cc2C)cc(C#Cc2ccc(N)cc2)c1O
CC1(C)C2CC1C(CC2)NC(=O)c1cc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)ccc1O |THB:9:6:1:4|
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1C(=O)NC1CCCCC1
Cc1cc(cc(c1Oc2ccc(c(c2)C(C)C)O)C)N3C(=O)NC(=O)C=N3
CN1CCN(CC1)S(=O)(=O)c1cc(Oc2c(C)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)ccc1O
Cc1cc(cc(Cl)c1Oc1ccc(O)c(c1)S(=O)(=O)N1CCOCC1)-n1ncc(=O)[nH]c1=O
CC(C)c1cc(Oc2c(C)cc(cc2C)N2CCCNC2=O)ccc1O
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1C(=O)NC1CCC1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1C(=O)N1CCCCC1
CSc1ccc(Oc2c(C)cc(cc2C)-n2ncc(=O)[nH]c2=O)cc1C
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1C(=O)N1CCOCC1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)Nc1ccccc1
Cc1cc(cc(C)c1Oc1ccc(O)c(c1)S(=O)(=O)N1CCCCC1)-n1ncc(=O)[nH]c1=O
Cc1cc(cc(Cl)c1Oc1ccc(O)c(c1)C(=O)N1CCCCC1)-n1ncc(=O)[nH]c1=O
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)N1C2CCC1CC1(C2)OCCO1 |THB:24:27:33.32.34:29.30|
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)NC1CCC1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)N1CCCCC1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)NC1CCCCC1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)n1ccc2ccccc12
Cc1cc(cc(Cl)c1Oc1ccc(O)c(c1)S(=O)(=O)N1CCCCC1)-n1ncc(=O)[nH]c1=O
CC(C)c1cc(Cc2c(C)cc(CCC(O)=O)cc2C)ccc1O
CC(C)c1cc(Cc2c(C)cc(C[C@H](N)C(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(C)cc(OCC(O)=O)cc2C)ccc1O
Clc1ccc2c(ccnc2c1)-c1c2CCCn2nc1-c1ccccn1 |(-1.09,-1.49,;.42,-1.79,;1.43,-.64,;2.94,-.93,;3.43,-2.4,;4.94,-2.69,;5.45,-4.15,;4.43,-5.31,;2.92,-5.01,;2.43,-3.55,;.92,-3.24,;5.96,-1.52,;5.46,-.05,;4.2,.83,;4.67,2.3,;6.2,2.3,;6.69,.85,;7.95,-.03,;7.5,-1.51,;8.48,-2.69,;7.93,-4.13,;8.9,-5.32,;10.43,-5.06,;10.98,-3.62,;10,-2.45,)|
CCc1cccc(n1)-c1nn2CCCc2c1-c1ccnc2ccccc12 |(11.57,-4.8,;10.62,-3.57,;9.1,-3.78,;8.5,-5.22,;6.98,-5.41,;6.04,-4.19,;6.64,-2.75,;8.16,-2.56,;5.7,-1.54,;6.15,-.05,;4.87,.79,;4.36,2.23,;2.84,2.2,;2.4,.74,;3.65,-.12,;4.15,-1.57,;3.22,-2.8,;3.82,-4.22,;2.89,-5.46,;1.36,-5.25,;.77,-3.83,;-.76,-3.64,;-1.37,-2.22,;-.42,-.99,;1.1,-1.19,;1.7,-2.61,)|
COc1ccc(cc1)-c1c2CCCn2nc1-c1ccccn1
CCSc1ccc2c(ccnc2c1)-c1c2CCCn2nc1-c1ccccn1 |(-1.24,-3.83,;-1.7,-2.36,;-.65,-1.22,;.85,-1.55,;1.89,-.43,;3.39,-.75,;3.85,-2.24,;5.35,-2.57,;5.82,-4.04,;4.77,-5.19,;3.27,-4.84,;2.81,-3.37,;1.31,-3.03,;6.4,-1.45,;5.95,.04,;4.71,.96,;5.21,2.43,;6.74,2.4,;7.19,.93,;8.43,,;7.94,-1.45,;8.89,-2.67,;8.31,-4.09,;9.25,-5.3,;10.79,-5.09,;11.37,-3.67,;10.41,-2.46,)|
CCS(=O)(=O)c1ccc2c(ccnc2c1)-c1c(nn2CCCc12)-c1ccccn1 |(-1.2,-3.92,;-1.69,-2.45,;-.67,-1.31,;-1.16,.14,;-.2,-2.78,;.82,-1.63,;1.85,-.47,;3.35,-.78,;3.84,-2.24,;5.34,-2.56,;5.83,-4.03,;4.8,-5.17,;3.3,-4.86,;2.82,-3.4,;1.31,-3.08,;6.38,-1.4,;7.9,-1.4,;8.36,.07,;7.12,.97,;6.64,2.41,;5.12,2.44,;4.64,.97,;5.89,.06,;8.88,-2.59,;8.32,-4.03,;9.27,-5.22,;10.81,-4.98,;11.37,-3.55,;10.39,-2.36,)|
Cc1ccc(cc1)-c1c2CCCn2nc1-c1cccc(C)n1
OCc1cccc(n1)-c1nn2CCCc2c1-c1ccc(F)cc1
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccc(F)cc1
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccc(O)cc1
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccc(F)c(F)c1
Fc1ccc(cc1)-c1c2CCCn2nc1-c1cccc(n1)C(F)(F)F
C1Cc2c(c(nn2C1)-c1ccccn1)-c1ccnc2ccccc12 |(3.84,2.2,;3.4,.74,;4.66,-.12,;5.17,-1.57,;6.7,-1.53,;7.15,-.05,;5.87,.81,;5.36,2.25,;7.65,-2.75,;7.05,-4.17,;8.01,-5.39,;9.53,-5.19,;10.11,-3.75,;9.17,-2.54,;4.24,-2.8,;4.84,-4.22,;3.91,-5.45,;2.39,-5.26,;1.79,-3.84,;.26,-3.66,;-.34,-2.24,;.59,-1.01,;2.1,-1.19,;2.7,-2.61,)|
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccnc2ccccc12 |(10.94,-4.02,;9.4,-4.18,;8.78,-5.62,;7.25,-5.76,;6.34,-4.52,;6.97,-3.11,;8.49,-2.94,;6.06,-1.86,;6.53,-.4,;5.29,.49,;4.81,1.95,;3.29,1.95,;2.8,.5,;4.04,-.4,;4.5,-1.86,;3.55,-3.06,;4.11,-4.5,;3.15,-5.71,;1.63,-5.48,;1.07,-4.04,;-.46,-3.81,;-1.02,-2.36,;-.06,-1.16,;1.45,-1.4,;2.03,-2.83,)|
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccc(cc1)S(C)(=O)=O
Fc1ccc(nc1)-c1nn2CCCc2c1-c1ccnc2ccccc12 |(10.22,-5.86,;9.24,-4.65,;7.71,-4.87,;6.78,-3.66,;7.35,-2.24,;8.87,-2.02,;9.83,-3.22,;6.4,-1.03,;6.87,.43,;5.64,1.34,;5.17,2.79,;3.66,2.83,;3.16,1.36,;4.4,.44,;4.86,-1.02,;3.82,-2.16,;4.29,-3.63,;3.24,-4.77,;1.75,-4.43,;1.29,-2.96,;-.22,-2.64,;-.69,-1.16,;.36,-.03,;1.85,-.36,;2.31,-1.82,)|
Fc1ccc(cc1)-c1c2CCCn2nc1-c1ccccn1
COc1ccc(cc1)-c1c2CCCn2nc1-c1cccc(C)n1
Cc1cccc(n1)-c1nn2CCCc2c1-c1ccnc2cc(Cl)ccc12 |(11.77,-3.83,;10.24,-4.04,;9.66,-5.47,;8.12,-5.67,;7.17,-4.46,;7.75,-3.03,;9.29,-2.82,;6.81,-1.82,;7.31,-.36,;6.07,.58,;5.62,2.03,;4.09,2.08,;3.58,.61,;4.81,-.31,;5.28,-1.8,;4.23,-2.92,;4.67,-4.41,;3.64,-5.54,;2.13,-5.19,;1.68,-3.72,;.17,-3.37,;-.28,-1.9,;-1.79,-1.55,;.77,-.77,;2.26,-1.1,;2.71,-2.59,)|
CCOc1ccc2c(ccnc2c1)-c1c2CCCn2nc1-c1cccc(C)n1 |(-1.9,-4.25,;-2.4,-2.8,;-1.4,-1.64,;.1,-1.92,;1.12,-.75,;2.62,-1.05,;3.13,-2.5,;4.64,-2.8,;5.15,-4.25,;4.13,-5.41,;2.63,-5.13,;2.13,-3.67,;.61,-3.39,;5.65,-1.63,;5.15,-.17,;3.88,.71,;4.34,2.21,;5.87,2.21,;6.37,.76,;7.63,-.12,;7.18,-1.59,;8.18,-2.78,;7.64,-4.22,;8.62,-5.4,;10.14,-5.15,;10.68,-3.7,;12.19,-3.45,;9.7,-2.52,)|
CC(C)c1cccc(n1)-c1nn2CCCc2c1-c1ccnc2ccccc12 |(11.23,-4.96,;10.3,-3.73,;10.9,-2.31,;8.78,-3.92,;8.18,-5.36,;6.64,-5.57,;5.71,-4.32,;6.32,-2.91,;7.85,-2.71,;5.38,-1.68,;5.83,-.21,;4.55,.67,;4.06,2.11,;2.54,2.09,;2.08,.62,;3.34,-.26,;3.84,-1.71,;2.9,-2.93,;3.49,-4.36,;2.55,-5.57,;1.03,-5.38,;.44,-3.94,;-1.09,-3.76,;-1.68,-2.33,;-.74,-1.1,;.78,-1.3,;1.37,-2.73,)|
Cc1cn(Cc2ccc(O)c(c2)C2CCCCC2)c2ccc(OCC(O)=O)cc12
Cc1cn(Cc2ccc(O)c(c2)-c2ccccc2)c2ccc(OCC(O)=O)cc12
Cc1cn(Cc2ccc(O)c(CC3CCCCC3)c2)c2ccc(OCC(O)=O)cc12
Cc1cn(Cc2ccc(O)c(c2)C2CCCC2)c2ccc(OCC(O)=O)cc12
Cc1cn(Cc2ccc(O)c(Cc3ccccc3)c2)c2ccc(OCC(O)=O)cc12
Cc1cn(Cc2ccc(O)c(c2)C(C)(C)C)c2ccc(OCC(O)=O)cc12
CC(C)c1cc(Cn2cc(C)c3cc(OCC(O)=O)cc(Cl)c23)ccc1O
CC(C)c1cc(Cn2cc(C)c3cc(OCC(O)=O)cc(C)c23)ccc1O
CC(C)c1cc(Cn2c(C)cc3cc(OCC(O)=O)cc(Cl)c23)ccc1O
CC(C)c1cc(Cn2c(C)cc3cc(OCC(O)=O)cc(C)c23)ccc1O
CC(C)c1cc(Cn2ccc3cc(OCC(O)=O)cc(Cl)c23)ccc1O
CC(C)c1cc(Cn2ccc3cc(OCC(O)=O)cc(C)c23)ccc1O
CC(C)c1cc(Cn2cc(C)c3cc(OCC(O)=O)ccc23)ccc1O
CC(C)c1cc(Cn2c(C)cc3cc(OCC(O)=O)ccc23)ccc1O
CC(C)c1cc(Cn2ccc3cc(OCC(O)=O)ccc23)ccc1O
OC(=O)Cc1cc(Cl)c(c(Cl)c1)-c1cccc2c(Br)c(O)ccc12 |(13.87,-1.24,;12.53,-2.03,;12.54,-3.57,;11.2,-1.26,;9.85,-2.04,;9.87,-3.58,;8.52,-4.35,;8.52,-5.89,;7.19,-3.58,;7.19,-2.04,;5.86,-1.27,;8.52,-1.27,;5.86,-4.36,;5.86,-5.89,;4.53,-6.67,;3.2,-5.9,;3.2,-4.36,;1.87,-3.59,;.52,-4.36,;1.87,-2.05,;.54,-1.28,;3.2,-1.27,;4.53,-2.04,;4.53,-3.59,)|
OC(=O)CCC(=O)Nc1cc(Cl)c(c(Cl)c1)-c1cccc2c(Br)c(O)ccc12 |(16.55,-3.2,;15.2,-2.43,;15.2,-.89,;13.87,-3.22,;12.54,-2.46,;12.53,-.92,;13.87,-.14,;11.2,-.15,;9.85,-.92,;8.52,-.16,;7.19,-.93,;5.86,-.16,;7.19,-2.47,;8.52,-3.24,;8.52,-4.78,;9.87,-2.46,;5.86,-3.25,;5.86,-4.78,;4.53,-5.56,;3.2,-4.79,;3.2,-3.25,;1.87,-2.48,;.52,-3.25,;1.87,-.93,;.54,-.17,;3.2,-.16,;4.53,-.93,;4.53,-2.48,)|
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(Br)c2)c(Cl)c1
Cc1c(O)ccc2c(cccc12)-c1c(Cl)cc(NC(O)=O)cc1Cl |(.52,-3.25,;1.87,-2.48,;1.87,-.93,;.54,-.17,;3.2,-.16,;4.53,-.93,;4.53,-2.48,;5.86,-3.25,;5.86,-4.78,;4.53,-5.56,;3.2,-4.79,;3.2,-3.25,;7.19,-2.47,;7.19,-.93,;5.86,-.16,;8.52,-.16,;9.85,-.92,;11.2,-.15,;12.53,-.92,;12.54,-2.46,;13.87,-.14,;9.87,-2.46,;8.52,-3.24,;8.52,-4.78,)|
OC(=O)C(=O)Nc1cc(Cl)c(c(Cl)c1)-c1cccc2c(Br)c(O)ccc12 |(11.21,-4.35,;12.54,-3.57,;13.87,-4.32,;12.53,-2.03,;13.87,-1.24,;11.2,-1.26,;9.85,-2.04,;8.52,-1.27,;7.19,-2.04,;5.86,-1.27,;7.19,-3.58,;8.52,-4.35,;8.52,-5.89,;9.87,-3.58,;5.86,-4.36,;5.86,-5.89,;4.53,-6.67,;3.2,-5.9,;3.2,-4.36,;1.87,-3.59,;.52,-4.36,;1.87,-2.05,;.54,-1.28,;3.2,-1.27,;4.53,-2.04,;4.53,-3.59,)|
COc1ccc2c(cccc2c1C(C)C)-c1c(Cl)cc(NC(=O)CC(O)=O)cc1Cl |(1.71,1.66,;1.71,.12,;3.04,-.65,;4.37,.13,;5.72,-.64,;5.72,-2.19,;7.05,-2.96,;7.05,-4.49,;5.7,-5.27,;4.37,-4.5,;4.37,-2.96,;3.04,-2.19,;1.71,-2.96,;.38,-2.19,;1.71,-4.5,;8.38,-2.18,;9.71,-2.95,;9.71,-4.49,;11.04,-2.18,;11.04,-.64,;12.37,.14,;13.7,-.63,;15.05,.16,;13.72,-2.17,;15.06,-2.92,;15.06,-4.46,;16.39,-2.15,;9.71,.13,;8.38,-.64,;7.05,.13,)|
OC(=O)CCNc1cc(Cl)c(c(Cl)c1)-c1cccc2c(Br)c(O)ccc12 |(13.88,-5.86,;13.87,-4.32,;15.2,-3.55,;12.54,-3.57,;12.53,-2.03,;11.2,-1.26,;9.85,-2.04,;8.52,-1.27,;7.19,-2.04,;5.86,-1.27,;7.19,-3.58,;8.52,-4.35,;8.52,-5.89,;9.87,-3.58,;5.86,-4.36,;5.86,-5.89,;4.53,-6.67,;3.2,-5.9,;3.2,-4.36,;1.87,-3.59,;.52,-4.36,;1.87,-2.05,;.54,-1.28,;3.2,-1.27,;4.53,-2.04,;4.53,-3.59,)|
OC(=O)CNc1cc(Cl)c(c(Cl)c1)-c1cccc2c(Br)c(O)ccc12 |(11.21,-4.35,;12.54,-3.57,;13.87,-4.32,;12.53,-2.03,;11.2,-1.26,;9.85,-2.04,;8.52,-1.27,;7.19,-2.04,;5.86,-1.27,;7.19,-3.58,;8.52,-4.35,;8.52,-5.89,;9.87,-3.58,;5.86,-4.36,;5.86,-5.89,;4.53,-6.67,;3.2,-5.9,;3.2,-4.36,;1.87,-3.59,;.52,-4.36,;1.87,-2.05,;.54,-1.28,;3.2,-1.27,;4.53,-2.04,;4.53,-3.59,)|
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)cc2)c(Cl)c1
OC(=O)Nc1cc(Cl)c(c(Cl)c1)-c1cccc2c(c(O)ccc12)-c1ccccc1 |(12.54,-2.46,;12.53,-.92,;13.87,-.14,;11.2,-.15,;9.85,-.92,;9.87,-2.46,;8.52,-3.24,;8.52,-4.78,;7.19,-2.47,;7.19,-.93,;5.86,-.16,;8.52,-.16,;5.86,-3.25,;5.86,-4.78,;4.53,-5.56,;3.2,-4.79,;3.2,-3.25,;1.87,-2.48,;1.87,-.93,;.54,-.17,;3.2,-.16,;4.53,-.93,;4.53,-2.48,;.52,-3.25,;.54,-4.78,;-.79,-5.56,;-2.14,-4.79,;-2.14,-3.25,;-.79,-2.48,)|
OC(=O)CC(=O)Nc1cc(Cl)c(c(Cl)c1)-c1cccc2c(Br)c(O)ccc12 |(13.88,-4.76,;13.87,-3.22,;15.2,-2.45,;12.54,-2.46,;12.53,-.92,;13.87,-.14,;11.2,-.15,;9.85,-.92,;9.87,-2.46,;8.52,-3.24,;8.52,-4.78,;7.19,-2.47,;7.19,-.93,;5.86,-.16,;8.52,-.16,;5.86,-3.25,;5.86,-4.78,;4.53,-5.56,;3.2,-4.79,;3.2,-3.25,;1.87,-2.48,;.52,-3.25,;1.87,-.93,;.54,-.17,;3.2,-.16,;4.53,-.93,;4.53,-2.48,)|
OC(=O)Cc1cc(Cl)c(c(Cl)c1)-c1cccc2cc(O)ccc12 |(13.87,-1.24,;12.53,-2.03,;12.54,-3.57,;11.2,-1.26,;9.85,-2.04,;9.87,-3.58,;8.52,-4.35,;8.52,-5.89,;7.19,-3.58,;7.19,-2.04,;5.86,-1.27,;8.52,-1.27,;5.86,-4.36,;5.86,-5.89,;4.53,-6.67,;3.2,-5.9,;3.2,-4.36,;1.87,-3.59,;1.87,-2.05,;.54,-1.28,;3.2,-1.27,;4.53,-2.04,;4.53,-3.59,)|
N[C@H](Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)C(O)=O
CC(C)c1cc(Oc2c(C)cc3nc(ccc3c2C)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(Cl)cc3nc(cc(O)c3c2Cl)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(Cl)cc3[nH]c(cc3c2Cl)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(Br)cc3nc(cc(O)c3c2Br)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(Br)cc3[nH]c(cc3c2Br)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(Br)cc3CC(Cc3c2Br)C(O)=O)ccc1O
CC(C)c1cc(Oc2c(C)cc3nc(cc(O)c3c2C)C(O)=O)ccc1O
CC(C)c1cc(Cc2c(C)cc(OCP(O)(O)=O)cc2C)ccc1O
CC(C)c1cc(Cc2c(C)cc(OCP3(=O)OCC[C@H](O3)c3cccc(Cl)c3)cc2C)ccc1O |r|
CC(C)(C)c1cc(Oc2c(Cl)cc(Nc3c(O)c(=O)c3=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(Nc3c(O)c(=O)c3=O)cc2Cl)ccc1O
Oc1ccc(Oc2c(I)cc(CP(O)(O)=O)cc2I)cc1I
CC(C)c1cc(Oc2c(Br)cc(OCP(O)(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(I)cc(OCP(O)(O)=O)cc2I)ccc1O
CC(C)c1cc(Oc2c(C)cc(OCP(O)(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NCP(O)(O)=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(Br)cc(NCP(O)(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(C)cc(SCP(O)(O)=O)cc2C)ccc1O
NC(Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1)P(O)(O)=O
CC(C)c1cc(Oc2c(C)cc(NC(=O)P(O)(O)=O)cc2C)ccc1O
Cc1cc(Cc2c(C)cc(OCP(O)(O)=O)cc2C)ccc1O
CCc1cc(Cc2c(C)cc(OCP(O)(O)=O)cc2C)ccc1O
Cc1cc(OCP(O)(O)=O)cc(C)c1Cc1ccc(O)c(c1)-c1ccccc1
CCC(C)c1cc(Cc2c(C)cc(OCP(O)(O)=O)cc2C)ccc1O
COc1cc(OCP(O)(O)=O)cc(OC)c1Cc1ccc(O)c(c1)C(C)C
CC(C)c1cc(Cc2c(C)cc(OCCP(O)(O)=O)cc2C)ccc1O
CC(C)c1cc(Cc2c(C)cc(CCP(O)(O)=O)cc2C)ccc1O
CC(C)c1cc(Cc2c(C)cc(NCP(O)(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(C)cc(CP(O)(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(CP(O)(O)=O)cc2Cl)ccc1O
CC(C)c1cc(Oc2c(Br)cc(CP(O)(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(Br)cc(CCP(O)(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(I)cc(CP(O)(O)=O)cc2I)ccc1O
CCCCCCCc1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1)C(=O)CCN1CCCC1
CCCCCCOc1cc(C)c(C(=O)CCN2CCNC(=O)C2)c(C)c1
CCCCCCOc1ccc(cc1)C(=O)CCN1CC1C
CCCCCCOc1ccc(C(=O)CCN(C)C)c(OC)c1
CCCCCCSc1ccc(C(=O)CCN(C)C)c(Cl)c1Cl
CCCCCCSc1ccc(C(=O)CCN2CCOCC2)c(Cl)c1Cl
CCCCCCSc1cc(Cl)c(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN(C)C)c(Br)c1
CCCCCCOc1cc(Cl)c(cc1Cl)C(=O)CCN1CCOCC1
CCCCCCOc1cc(Cl)c(C(=O)CCN2CCNC(=O)C2)c(Cl)c1
CCCCCCSc1ccc(C(=O)CCN(C)C)c(Cl)c1
CCCCCCSc1cc(C)c(C(=O)CCN(C)C)c(C)c1
CCCCCCS(=O)(=O)c1cc(C)c(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(C)c1
CCCCCCOc1ccc2C(=O)C(CN(C)C)COc2c1
CCCCCCSc1cc(C)c(C(=O)CCN2CCOCC2)c(C)c1
CCCCCCOc1cc(C)c(C(=O)CCN(C)C)c(C)c1
CCCCCCOc1ccc2C(=O)C(CN(C)C)Cc2c1
CCCCCCOc1cc(Cl)c(cc1Cl)C(=O)CCN1CCN(CC1)S(=O)(=O)CC
CCCCCCSc1ccc(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1
CCCCCCSc1cc(Cl)c(C(=O)CCN(C)C)c(Cl)c1
CCCCCCSc1cc(Cl)c(C(=O)CCN2CCNC(=O)C2)c(Cl)c1
CCCCCCS(=O)(=O)c1cc(Cl)c(cc1Cl)C(=O)CCN1CC1C
CCCCCCOc1cc(C(C)C)c(cc1C)C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN(C)C)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN2CCOCC2)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN(C)C)c(c1)C(F)(F)F
CCCCCCOc1cc(C)c(C(=O)CCN2CCN(CC2)C(C)=O)c(C)c1
CCCCCCOc1ccc(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1
CCCCCCOc1cc(Cl)c(cc1Cl)C(=O)CCN1CCNC(=O)C1
CCCCCCOc1cc(C)c(C(=O)CCN2CCOCC2)c(C)c1
CCCCCCSc1ccc(C(=O)CCN2CCNC(=O)C2)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN(C)C)c(I)c1
CCCCCCS(=O)(=O)c1cc(Cl)c(cc1Cl)C(=O)CCN(C)C
CCCCCCS(=O)(=O)c1cc(Cl)c(C(=O)CCN2CC2C)c(Cl)c1
CCCCCCOc1ccc2C(=O)C(CN(C)C)CCc2c1
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CC2C)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN(C)C)c(c1)S(C)(=O)=O
CCCCCCSc1cc(Cl)c(C(=O)CCN2CC2C)c(Cl)c1
CCCCCCOc1ccc(cc1Br)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1I)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1C(F)(F)F)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1)C(=O)CCN(CCCC)CCCC
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN(C)C)c(Cl)c1Cl
CCCCCCOc1ccc(cc1[N+]([O-])=O)C(=O)CCN(C)C
CCCCCCS(=O)(=O)c1cc(C)c(C(=O)CCN2CC2C)c(C)c1
CCCCCCSc1ccc(C(=O)CCN2CC2C)c(Cl)c1Cl
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN(C)C)c(Cl)c1
CCCCCCOc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccccc1
CCCCCCOc1ccc(C(=O)CCN(C)C)c2ccccc12
CCCCCCOc1cc(C)c(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(C)c1
CCCCCCSc1cc(C)c(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(C)c1
CCCCCCS(=O)(=O)c1cc(C)c(C(=O)CCN2CCN(CC2)C(C)=O)c(C)c1
CCCCCCOc1ccc(cc1)C(=O)CCN1CCOCC1
CCCCCCSc1cc(Cl)c(cc1Cl)C(=O)CCN1CC1C
CCCCCCOc1ccc(cc1Cl)C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN2CC2C)c(Cl)c1
CCCCCCOc1ccc(cc1F)C(=O)CCN(C)C
CCCCCCOc1cc(Cl)c(C(=O)CCN2CC2C)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN2CCNC(=O)C2)c(Cl)c1
CCCCCCS(=O)(=O)c1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1C(C)(C)C)C(=O)CCN(C)C
CCCCCCOc1c(C)cc(cc1C)C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN2CC2C)c(Cl)c1Cl
CCCCCCOc1cc(Cl)c(cc1Cl)C(=O)CCN1CC1C
CCCCCCOc1ccc(cc1SC)C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN(C)C)c(C)c1
CCCCCCSc1cc(C)c(C(=O)CCN2CC2C)c(C)c1
CCCCCCSc1ccc(C(=O)CCN2CC2C)c(Cl)c1
CCCCCCS(=O)(=O)c1cc(C)c(C(=O)CCN2CCNC(=O)C2)c(C)c1
CCCCCCOc1ccc(cc1)C(=O)CCN1CCN(C)CC1
CCCCCCSc1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1cc(C)c(C(=O)CCN2CC2C)c(C)c1
CCCCCCOc1ccc(cc1OC)C(=O)CCN(C)C
CCCCCCOc1cccc(c1)C(=O)CCN(C)C
CCCCCCNC(=O)c1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1S(C)(=O)=O)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1)C(=O)CCN1CCCCC1
CCCCCCOc1ccc(cc1C)C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN(C)C)c(SC)c1
CCCCCCSc1cc(C)c(C(=O)CCN2CCNC(=O)C2)c(C)c1
CCCCCC(=O)Nc1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1-c1ccccc1)C(=O)CCN(C)C
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1
CCCCCCOc1cc(Cl)c(cc1Cl)C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1Cl
CCCCCCOc1cc(Cl)c(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1
CCCCCCSc1ccc(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1
CCCCCCSc1cc(Cl)c(cc1Cl)C(=O)CCN1CCNC(=O)C1
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCOCC2)c(Cl)c1
CCCCCCS(=O)(=O)c1cc(Cl)c(cc1Cl)C(=O)CCN1CCNC(=O)C1
CCCCCCOc1cc(Cl)c(C(=O)CCN(C)C)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN2CCOCC2)c(Cl)c1Cl
CCCCCCSc1ccc(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1Cl
CCCCCCSc1cc(Cl)c(cc1Cl)C(=O)CCN1CCN(CC1)S(=O)(=O)CC
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCNC(=O)C2)c(Cl)c1
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCOCC2)c(Cl)c1Cl
CCCCCCS(=O)(=O)c1cc(Cl)c(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1
CCCCCCOc1cc(Cl)c(cc1Cl)C(=O)CCN1CCN(CC1)C(C)=O
CCCCCCOc1cc(Cl)c(C(=O)CCN2CCOCC2)c(Cl)c1
CCCCCCOc1cc(Cl)c(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1
CCCCCCSc1ccc(C(=O)CCN2CCOCC2)c(Cl)c1
CCCCCCSc1ccc(C(=O)CCN2CCNC(=O)C2)c(Cl)c1Cl
CCCCCCSc1cc(Cl)c(cc1Cl)C(=O)CCN1CCN(CC1)C(C)=O
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCNC(=O)C2)c(Cl)c1Cl
CCCCCCS(=O)(=O)c1cc(Cl)c(cc1Cl)C(=O)CCN1CCN(CC1)C(C)=O
CCCCCCS(=O)(=O)c1cc(Cl)c(cc1Cl)C(=O)CCN1CCN(CC1)S(=O)(=O)CC
CCCCCCS(=O)(=O)c1cc(Cl)c(C(=O)CCN2CCOCC2)c(Cl)c1
CCCCCCS(=O)(=O)c1cc(Cl)c(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1
CCCCCCSc1ccc(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1Cl
CCCCCCSc1cc(C)c(C(=O)CCN2CCN(CC2)C(C)=O)c(C)c1
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1Cl
CCCCCCS(=O)(=O)c1cc(Cl)c(cc1Cl)C(=O)CCN1CCOCC1
CCCCCCS(=O)(=O)c1cc(C)c(C(=O)CCN2CCOCC2)c(C)c1
CCCCCCSc1cc(Cl)c(cc1Cl)C(=O)CCN1CCOCC1
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1Cl
CCCCCCS(=O)(=O)c1cc(Cl)c(C(=O)CCN2CCNC(=O)C2)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN(C)C)c(Cl)c1Cl
CCCCCCSc1cc(Cl)c(C(=O)CCN2CCOCC2)c(Cl)c1
CCCCCCSc1cc(Cl)c(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1
CCCCCCS(=O)(=O)c1cc(Cl)c(C(=O)CCN(C)C)c(Cl)c1
CCCCCCS(=O)(=O)c1cc(C)c(C(=O)CCN(C)C)c(C)c1
CCCCCCOc1ccc(C(=O)CCN2CCN(CC2)C(C)=O)c(Cl)c1
CCCCCCOc1ccc(C(=O)CCN2CCNC(=O)C2)c(Cl)c1Cl
CCCCCCOc1ccc(C(=O)CCN2CCN(CC2)S(=O)(=O)CC)c(Cl)c1Cl
CCCCCCSc1cc(Cl)c(cc1Cl)C(=O)CCN(C)C
CCCCCCS(=O)(=O)c1ccc(C(=O)CCN2CC2C)c(Cl)c1Cl
CCCCCCOc1cc(C)ccc1C(=O)CCN(C)C
CCCCCCOc1ccc(C(=O)CCN(C)C)c(c1)N(C)C
CCCCCCOc1ccc(cc1Cc1ccccc1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1)-c1ccc(cc1)C(=O)CCN(C)C
CCCCCCOc1ccc2cc(ccc2c1)C(=O)CCN(C)C
CCCCCCOc1ccc(cc1)C(=O)C(C)CN(C)C
CCCCCCOc1ccc(cc1)C(=O)C(CN(C)C)C(C)C
CCCCCCOc1ccc(cc1)C(=O)C(CN(C)C)c1ccccc1
CCCCCCOc1ccc(cc1)C(=O)CCN(C)c1ccccc1
CCCCCCOc1ccc(cc1)C(=O)CCNc1ccccc1
CCCCCCOc1ccc(cc1)C(=O)CCNc1cccc(Cl)c1
CCCCCCOc1ccc(cc1)C(=O)CCn1ccnc1
CCCCCCOc1ccc(cc1)C(=O)CCN1C(=O)CCC1=O
CCOCCOc1ccc(cc1)C(=O)CCN(C)C
CCN1CCC(Cc2ccc(cc2)C(=O)CCN(C)C)CC1
CCCN1CCN(CC1)c1ccc(cc1)C(=O)CCN(C)C
CCCCCS(=O)(=O)Nc1ccc(cc1)C(=O)CCN(C)C
CCCCNC(=O)Nc1ccc(cc1)C(=O)CCN(C)C
Cc1cc(NC(=O)C(O)=O)cc(C)c1Oc1ccc(O)c2CCCc12
Cc1cc(NC(=O)CC(O)=O)cc(Cl)c1Oc1ccc(O)c(c1)S(=O)(=O)CC1CCC1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1C(=O)N1CCc2ccccc2C1
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1Cc1ccc(F)cc1
Cc1cc(cc(C)c1Oc1ccc(O)c(Cc2ccc(F)cc2)c1)-n1ncc(=O)[nH]c1=O
CCOC(=O)C(=O)Nc1cc(C)c(Oc2ccc(OC)c(c2)C(O)c2ccc(F)cc2)c(C)c1
OC(c1ccc(Cl)cc1)c1cc(Oc2c(Cl)cc(NC(=O)C(O)=O)cc2Cl)ccc1O
COc1ccc(Oc2c(C)cc(NC(=O)C(O)=O)cc2C)cc1C(C)C
Cc1cc(NC(=O)C(O)=O)cc(C)c1Oc1ccc(O)c(c1)C(=O)c1ccc(Cl)cc1
CNC(=O)C(=O)Nc1cc(Br)c(Oc2ccc(O)c(c2)C(C)C)c(Br)c1
CC(C)c1cc(Oc2c(C)cc(NC(Cc3ccccc3)C(O)=O)cc2C)ccc1O
CCOC(=O)C(=O)Nc1cc(C)c(Oc2ccc(O)c(c2)C(C)C)c(C)c1
CC(C)c1cc(Oc2c(C)cc(cc2C)N(C)C(=O)C(O)=O)ccc1O
COC(=O)C(=O)Nc1cc(C)c(Oc2ccc(OC)c(c2)C(C)C)c(C)c1
CC(C)c1cc(Oc2c(F)cc(NC(=O)C(O)=O)cc2F)ccc1O
CC(C)c1cc(Oc2c(C)cc(NC(=O)C(=O)OCc3ccccc3)cc2C)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NC(Cc3ccccc3)C(O)=O)cc2Cl)ccc1O
Cc1cc(NC(=O)C(O)=O)cc(C)c1Oc1ccc(O)c(c1)C(=O)c1ccc(F)cc1
OC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc(O)c(c2)C(=O)c2ccc(Cl)cc2)c(Cl)c1
CC(C)c1cc(Oc2c(C)cc(NC(C)C(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NC(C)C(O)=O)cc2Cl)ccc1O
COC(=O)C(=O)Nc1cc(C)c(Oc2cccc(c2)C(C)C)c(C)c1
CC(C)c1cc(Oc2c(C)cc(CCC(O)=O)cc2C)ccc1O
C[C@H](CCC(=O)NCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:62,69|
C[C@H](CCC(=O)N[C@@H](CCC(=O)N(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12)C(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C |t:36,43|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@@H](C[C@@H]4CC(O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCC(=O)N(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)N(C)C(=O)CCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|
CN(C(C)=O)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:27,34|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:60,67|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:59,66|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OC(=O)NCC(=O)N(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|
C[C@H](CCC(=O)NCCS(O)(=O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:65,72|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4CC(CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)N(C)C(=O)NCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:63,70|
Oc1[nH]c(=O)[nH]c1Cc1cc(I)c(Oc2ccc(O)c(Br)c2)c(I)c1
Oc1[nH]c(=O)[nH]c1Cc1cc(I)c(Oc2ccc(O)cc2)c(I)c1
Oc1[nH]c(=O)[nH]c1Cc1cc(I)c(Oc2ccc(O)c(c2)C2CC2)c(I)c1
Cc1cc(Oc2c(I)cc(Cc3[nH]c(=O)[nH]c3O)cc2I)ccc1O
COc1cc(Oc2c(I)cc(Cc3[nH]c(=O)[nH]c3O)cc2I)ccc1O
Oc1[nH]c(=O)[nH]c1Cc1cc(I)c(Oc2ccc(O)c(I)c2)c(I)c1
CCc1cc(Oc2c(I)cc(Cc3[nH]c(=O)[nH]c3O)cc2I)ccc1O
CC(C)c1cc(Oc2c(Br)cc(Cc3[nH]c(=O)[nH]c3O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(Cl)cc(NC(=O)CC(O)=O)c(Cl)c2Cl)ccc1O
CC(C)c1cc(ccc1O)Oc2c(cc(cc2Br)NC(=O)CC(=O)O)Br
CC(C)c1cc(Oc2c(C)cc(NC(=O)CC(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c(C)cc(NC(=O)CC(O)=O)c(C)c2C)ccc1O
CC(C)c1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2Br)ccc1O
CC(C)c1cc(Oc2c(Br)cc(NC(=O)CC(O)=O)c3CCCCc23)ccc1O
CC(C)c1cc(Oc2c3CCCc3c(NC(=O)C(O)=O)cc2C)ccc1O
CC(C)c1cc(Oc2c3CCCc3c(cc2C)C(=O)NCC(O)=O)ccc1O
CC(C)c1cc(Oc2c3CCCc3c(NS(=O)(=O)CC(O)=O)cc2C)ccc1O
CC(C)c1cc(Cc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O
CC(C)c1cc(ccc1O)C(=O)c1c2CCCc2c(NC(=O)CC(O)=O)cc1C
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)-c1ncc(s1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:24:25:22.23.28:29,THB:24:23:29:30.25.26,26:25:22:28.27.29,26:27:22:30.24.25|
Cc1nc(sc1C(=O)N1CCCCC1)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CC12CC(CC(C)(C)C1)N(C2)C(=O)c1sc(nc1C(F)(F)F)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CCc1nc(sc1C(=O)N1CC2(C)CC1CC(C)(C)C2)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1cccc(F)c1)C(=O)c1sc(nc1C(F)(F)F)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1)C(=O)c1sc(nc1C(F)(F)F)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1F)C(=O)c1sc(nc1C(F)(F)F)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)-c1nc(c(s1)C(=O)N1CCc2ccccc2C1)C(F)(F)F
CC1Cc2ccccc2N1C(=O)c1sc(nc1C(F)(F)F)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
Cc1nc(sc1C(=O)N1CC2(C)CC1CC(C)(C)C2)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CC1CCN(CC1)C(=O)c1sc(nc1C)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CCCN(C(=O)c1csc(n1)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
[H]C12CC3([H])CC([H])(C1)CC(C2)(C3)NC(=O)COC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O |TLB:8:6:12:1.11.2,8:1:12:6.9.5,THB:5:6:11:3.12.2|
CC1CCN(CC1)C(=O)c1sc(nc1C(F)(F)F)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)-c1nc(c(s1)C(=O)N1CCCCC1)C(F)(F)F
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)-c1ncc(s1)C(=O)N1CCCCC1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)-c1nc(c(s1)C(=O)N1CCCCC1)-c1ccccc1
CCc1nc(sc1C(=O)N1CCCCC1)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1cccc(F)c1)C(=O)c1cnc(s1)-c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)C(=O)NCC(c2ccccc2)c2ccccc2)c(Cl)c1
CC(C)c1cc(Cc2c(C)cc(OC[P@@]3(=O)OCC[C@H](O3)c3cccc(Cl)c3)cc2C)ccc1O |r|
CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C |c:18,t:11|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C)OCCOCCN(C)c1ccc(cc1)[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCC3=CC(=O)CCC3=C12 |t:62,69|
Oc1ccc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)cc1S(=O)(=O)N1CCc2ccccc12
CCCCc1oc2ccccc2c1C(=O)c1cc(I)c(CCN(CC)CC)c(I)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(c2)C(=O)NC(=O)c2ccccc2)c(Br)c1
CC1(C)C2CCC1(C)[C@@H](C2)NC(=O)c1cc(Oc2c(Cl)cc(cc2Cl)-n2ncc(=O)[nH]c2=O)ccc1O |THB:10:8:1:4.5|
CC(C)c1cc(Oc2c(Br)cc3NC(Cc3c2Br)C(O)=O)ccc1O
OC(=O)CCc1cc(Br)c(OC2CCCCC2)c(Br)c1
OC(=O)Cc1cc(Cl)c(Oc2ccc(O)c(c2)C(=O)NCc2ccccc2)c(Cl)c1
OC(=O)Cc1cc(Br)c(Oc2ccc(O)c(Cc3ccc(cc3)C(F)(F)F)c2)c(Br)c1
OC(=O)Cc1cc(Br)c(OC2CCCCC2)c(Br)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCC2CCCCC2)c1
CC(C)CCc1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O
CC(C)Cc1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O
CCc1cc(Oc2c3CCCc3c(NC(=O)CC(O)=O)cc2C)ccc1O
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)cc1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccc(O)cc2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2cccc(O)c2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccccc2O)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccc(Cl)cc2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2cccc(Cl)c2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccccc2Cl)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccc(F)c(F)c2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccc(F)cc2F)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCCc2ccccc2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(c1)C(=O)Cc1ccccc1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(c1)C(O)Cc1ccccc1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccc(F)cc2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(CCc2ccccc2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(Cc2ccc(=O)[nH]n2)c1
Cc1cc(NC(=O)CC(O)=O)c2CCCc2c1Oc1ccc(O)c(Cc2ccc(F)cc2)c1
COc1cc(O)c(C(CC(=O)N2C[C@@H](C)C[C@@H](C)C2)c2ccc3OCOc3c2)c(OC)c1 |r|
CC1Cc2ccccc2N1C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1Cc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCc2ccccc12
CN1CCN(CC1)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CC1CCN(CC1)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCCCC1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCN(CC1)c1ccc(F)cc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCN(CC1)c1ccccc1F
Cc1ccc(cc1)N1CCN(CC1)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCN(CC1)c1ccccc1
CC(C)N(C(C)C)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCC(CC1)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N(Cc1ccccc1)Cc1ccccc1
CN(Cc1cccc(F)c1)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1F)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1)C(=O)C1CCN(CC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N(Cc1ccccc1)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)N1CCc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)N1CCC(CC1)C(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:23:24:27:31.29.30,THB:29:28:25:31.30.32,29:30:27.28.33:25,32:30:27:33.24.25,32:24:27:31.29.30|
CC1Cc2ccccc2N1C(=O)CN(C)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1Cc2ccccc2C1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCc2ccccc12)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CC1CCN(CC1)C(=O)CN(C)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCCCC1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCN(CC1)c1ccc(cc1)C(F)(F)F)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCN(CC1)c1ccc(F)cc1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCN(CC1)c1ccccc1F)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCN(CC1)c1ccc(C)cc1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCN(CC1)c1ccccc1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N1CCC(CC1)c1ccccc1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N(Cc1ccccc1)Cc1ccccc1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N(C)Cc1cccc(F)c1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N(C)Cc1ccccc1F)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)N(C)Cc1ccccc1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CCCN(C(=O)CN(C)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CN(CC(=O)N1CCc2ccccc2C1)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(CC(=O)NC12CC3CC(CC(C3)C1)C2)C(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O |TLB:5:6:9:13.11.12,THB:11:10:7:13.12.14,11:12:9.10.15:7,14:12:9:15.6.7,14:6:9:13.11.12|
CC1Cc2ccccc2N1C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1Cc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCc2ccccc12
CC1CCN(CC1)C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCCCC1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCN(CC1)c1ccc(cc1)C(F)(F)F
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCN(CC1)c1ccc(F)cc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCN(CC1)c1ccccc1F
Cc1ccc(cc1)N1CCN(CC1)C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCN(CC1)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCC(CC1)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N(Cc1ccccc1)Cc1ccccc1
CN(Cc1cccc(F)c1)C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1F)C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1)C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CCCN(C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CN(C(=O)CCCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)N1CCc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCCC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:21:22:25:29.27.28,THB:27:26:23:29.28.30,27:28:25.26.31:23,30:28:25:31.22.23,30:22:25:29.27.28|
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCCc2ccccc12
CC1Cc2ccccc2N1C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1Cc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCc2ccccc12
CC1CCN(CC1)C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCCCC1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCN(CC1)c1ccc(cc1)C(F)(F)F
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCN(CC1)c1ccc(F)cc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCN(CC1)c1ccccc1F
Cc1ccc(cc1)N1CCN(CC1)C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCN(CC1)c1ccccc1
CC(C)N(C(C)C)C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCC(CC1)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N(Cc1ccccc1)Cc1ccccc1
CN(Cc1cccc(F)c1)C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1F)C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1)C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CCCN(C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CN(C(=O)CCNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)N1CCc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCCC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:20:21:24:28.26.27,THB:26:25:22:28.27.29,26:27:24.25.30:22,29:27:24:30.21.22,29:21:24:28.26.27|
CN1CCN(CC1)C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CC1CCN(CC1)C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCCCC1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCN(CC1)c1ccc(cc1)C(F)(F)F
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCN(CC1)c1ccc(F)cc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCN(CC1)c1ccccc1F
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCN(CC1)c1ccccc1
CC(C)N(C(C)C)C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCC(CC1)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N(Cc1ccccc1)Cc1ccccc1
CN(Cc1cccc(F)c1)C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1F)C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CN(Cc1ccccc1)C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N(Cc1ccccc1)c1ccccc1
CCCN(C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CN(C(=O)CNC(=O)c1ccc(c(c1)[N+]([O-])=O)S(C)(=O)=O)c1ccccc1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)N1CCc2ccccc2C1
CS(=O)(=O)c1ccc(cc1[N+]([O-])=O)C(=O)NCC(=O)NC12CC3CC(CC(C3)C1)C2 |TLB:19:20:23:27.25.26,THB:25:24:21:27.26.28,25:26:23.24.29:21,28:26:23:29.20.21,28:20:23:27.25.26|
Cc1[nH]c2cc(C)ccc2c1C(Nc1ccc(OC(F)(F)F)cc1)c1ccccc1Cl
CC(C)c1cc(Cn2ccc3c(NC(=O)CC(O)=O)ccc(C)c23)ccc1O
CC(C)c1cc(Cn2c(C)cc3c(NC(=O)CC(O)=O)cccc23)ccc1O
CC(C)c1cc(Cn2ccc3c(NC(=O)C(O)=O)cccc23)ccc1O
CC(C)c1cc(Cn2ccc3c(NC(=O)C(O)=O)ccc(C)c23)ccc1O
CC(C)c1cc(Cn2c(C)cc3c(NC(=O)C(O)=O)cccc23)ccc1O
CC(C)c1cc(Cn2c(C)c(CCCCC(O)=O)c3ccccc23)ccc1O
CC(C)c1cc(Cn2c(C)c(CCCC(O)=O)c3ccccc23)ccc1O
CC(C)c1cc(Cn2c(C)c(CCC(O)=O)c3ccccc23)ccc1O
CC(C)c1cc(Cn2c(C)c(CC(O)=O)c3ccccc23)ccc1O
CC(C)c1cc(Cn2c(C)c(C(=O)NCC(O)=O)c3ccccc23)ccc1O
CC(C)c1cc(Cn2c(C)c(CC(=O)NCC(O)=O)c3ccccc23)ccc1O
CC(C)c1cc(Cn2c(C)cc3cc(NC(=O)C(O)=O)ccc23)ccc1O
COC(=O)Cc1ccc(OCc2oc(nc2C)-c2cccc(OC)c2)cc1
COC(=O)c1ccc(OCc2oc(nc2C)-c2cccc(OC)c2)cc1
COC(=O)c1cccc(OCc2oc(nc2C)-c2ccccc2OC)c1
COC(=O)Cc1ccc(OCc2oc(nc2C)-c2ccccc2OC)cc1
c1cc(c(cc1Oc2c(cc(cc2I)C[C@@H](C(=O)O)N)I)I)O
N[C@@H](Cc1cc(Br)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O |r|
N[C@@H](Cc1cc(I)c(Oc2cc(I)c(O)c(I)c2)c(I)c1)C(O)=O |r|
OC(=O)Cc1cc(Br)c(Oc2cc(I)c(O)c(I)c2)c(I)c1
c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)CC(=O)O
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CCCC1
CCCN(CC1CCOC1)C(=O)c1cc(OC)c2oc(NCc3cccc(Cl)c3)nc2c1
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CCCC1(C)C
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CCC(C)(C)C1
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CCOCC1
CC1(CN(CCO1)C(=O)c2cc3c(c(c2)OC)oc(n3)NCc4cccc(c4)Cl)C
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CCC(O)CC1
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CC[C@@H](O)C(C)(C)C1 |r|
C[C@@H]1CN(CC[C@H]1O)C(=O)c2cc3c(c(c2)OC)oc(n3)NCc4cccc(c4)Cl
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CC[C@H](O)[C@@H](C)C1 |r|
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3cc(Cl)ccn3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3cncc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3ccnc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3cccc(Cl)n3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3cc(Cl)ccc3F)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3cc(Cl)ccc3O)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(N[C@@H](C)c3cccc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1 |r|
COc1cc(cc2nc(N[C@H](C)c3cccc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1 |r|
COc1cc(cc2nc(NC(c3cccc(Cl)c3)C(F)(F)F)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NC3(CC3)c3cccc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NC3(CCC3)c3cccc(Cl)c3)oc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2oc(NCc3cccc(Cl)c3)nc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cn2nc(NCc3cccc(Cl)c3)nc12)C(=O)N1CCC(O)C(C)C1
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CC(C)C(O)CC1C
CCC1CC(O)C(C)CN1C(=O)c1cc(OC)c2oc(NCc3cccc(Cl)c3)nc2c1
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CC(C)C(O)CC1C1CC1
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CC(C)C(O)CC1CCO
COc1cc(cc2nc(NCc3cccc(Cl)c3)oc12)C(=O)N1CC(C)CCC1CCO
COc1cc(cc2nc(N[C@H](C)c3cccc(Cl)c3)oc12)C(=O)N1CCOC(C)(CCO)C1 |r|
COc1cc(cc2nc(N[C@H](C)c3cccc(Cl)c3)oc12)C(=O)N1CC(C)(CCO)OC[C@H]1C |r|
CC[C@@H]1CO[C@@](CN1C(=O)c2cc3c(c(c2)OC)oc(n3)N[C@H](C)c4cccc(c4)Cl)(C)CCO
COc1cc(cc2nc(N[C@H](C)c3cccc(Cl)c3)oc12)C(=O)N1CC(C)OCC1CO |r|
C[C@H]1CN([C@H](CO1)CCO)C(=O)c2cc3c(c(c2)OC)oc(n3)N[C@H](C)c4cccc(c4)Cl
C[C@@H]1CN([C@@H](CO1)CCO)C(=O)c2cc3c(c(c2)OC)oc(n3)N[C@H](C)c4cccc(c4)Cl
COc1cc(cc2nc(N[C@H](C)c3cccc(Cl)c3)oc12)C(=O)N1CC(C)OCC1C1CC(O)C1 |r,wD:10.10,(20.64,-12.93,;19.31,-13.7,;19.32,-15.24,;17.99,-16.01,;17.98,-17.56,;19.32,-18.33,;20.66,-17.56,;22.14,-18.03,;23.04,-16.77,;24.58,-16.76,;25.36,-18.09,;26.9,-18.08,;24.6,-19.43,;25.38,-20.75,;24.63,-22.09,;23.08,-22.1,;22.3,-20.77,;20.76,-20.78,;23.06,-19.43,;22.12,-15.52,;20.65,-16.01,;16.65,-18.33,;16.65,-19.87,;15.32,-17.56,;15.32,-16.02,;13.99,-15.24,;14,-13.7,;12.65,-16.01,;12.65,-17.55,;13.98,-18.33,;13.98,-19.86,;12.89,-20.95,;13.98,-22.04,;13.97,-23.58,;15.07,-20.95,)|
COc1cc(cc2nc(NCc3cc(Cl)ccn3)oc12)C(=O)N1CC(C)(CCO)OC[C@H]1C |r|
COc1cc(cc2nc(NCc3cc(Cl)ccn3)oc12)C(=O)N1CC(C)OCC1CCO
COc1cc(cc2nc(NCc3cc(Cl)ccn3)oc12)C(=O)N1CC(C)OCC1C1CC(O)C1 |(46.57,-2.43,;45.24,-3.2,;45.25,-4.74,;43.92,-5.51,;43.92,-7.06,;45.25,-7.83,;46.59,-7.06,;48.07,-7.53,;48.97,-6.27,;50.51,-6.26,;51.29,-7.59,;50.53,-8.93,;48.99,-8.93,;48.23,-10.27,;46.69,-10.28,;49.01,-11.6,;50.56,-11.59,;51.31,-10.25,;48.05,-5.02,;46.58,-5.51,;42.58,-7.83,;42.58,-9.37,;41.25,-7.06,;41.25,-5.52,;39.92,-4.74,;39.93,-3.2,;38.58,-5.51,;38.58,-7.05,;39.91,-7.83,;39.91,-9.36,;38.82,-10.45,;39.91,-11.54,;39.91,-13.08,;41,-10.45,)|
COc1cc(cn2nc(NCc3cccc(Cl)c3)nc12)C(=O)N1CC(C)(CCO)OC[C@H]1C |r|
COc1cc(cn2nc(NCc3cccc(Cl)c3)nc12)C(=O)N1CC(C)OCC1CCO
COc1cc(cn2nc(NCc3cccc(Cl)c3)nc12)C(=O)N1CC(C)OCC1C1CC(O)C1 |(16.59,-6.65,;15.26,-7.42,;15.26,-8.96,;13.93,-9.73,;13.93,-11.27,;15.27,-12.04,;16.61,-11.27,;18.09,-11.74,;18.99,-10.48,;20.53,-10.48,;21.31,-11.8,;20.55,-13.14,;21.33,-14.46,;20.57,-15.8,;19.03,-15.82,;18.25,-14.49,;16.71,-14.49,;19.01,-13.15,;18.07,-9.24,;16.6,-9.72,;12.6,-12.04,;12.6,-13.58,;11.27,-11.27,;11.27,-9.73,;9.94,-8.96,;9.95,-7.42,;8.6,-9.72,;8.6,-11.27,;9.93,-12.05,;9.93,-13.59,;8.84,-14.67,;9.93,-15.76,;9.92,-17.3,;11.02,-14.67,)|
COc1cc(cc2nc(N[C@H](CF)c3cccc(Cl)c3)oc12)C(=O)N1CC(C)(CCO)OC[C@H]1C |r|
C[C@H]1CN([C@H](CO1)CCO)C(=O)c2cc3c(c(c2)OC)oc(n3)N[C@H](CF)c4cccc(c4)Cl
COc1cc(cc2nc(N[C@H](CF)c3cccc(Cl)c3)oc12)C(=O)N1CC(C)OCC1C1CC(O)C1 |r,wU:10.9,(-3.32,5.32,;-1.98,4.55,;-1.98,3.01,;-3.32,2.24,;-3.32,.7,;-1.98,-.07,;-.65,.7,;.82,.23,;1.72,1.47,;3.26,1.47,;4.03,.14,;3.26,-1.19,;4.03,-2.53,;5.57,.14,;6.34,1.47,;7.88,1.47,;8.65,.14,;7.88,-1.19,;8.65,-2.53,;6.34,-1.19,;.82,2.72,;-.65,2.24,;-4.65,-.07,;-4.65,-1.61,;-5.98,.7,;-5.98,2.24,;-7.32,3.01,;-7.32,4.55,;-8.65,2.24,;-8.65,.7,;-7.32,-.07,;-7.32,-1.61,;-8.41,-2.69,;-7.32,-3.78,;-7.32,-5.32,;-6.23,-2.69,)|
Clc1cccc(CNC(=O)c2ccc3cn(CCn4cccn4)nc3c2)c1
Clc1cccc(CNC(=O)c2cc(Cl)c3cn(CCn4cccn4)nc3c2)c1
COc1cc(cc2nn(CCn3cccn3)cc12)C(=O)NCc1cccc(Cl)c1
CCn1cccc(-c2ccc(cc2OC)N2C[C@H](CNC(=O)c3ccc(Cl)s3)OC2=O)c1=O |r|
COc1ccc(cc1OC)-n1cc(nc1NC(=O)CN(C(C)C)C(=O)Cc1cccc(Cl)c1)-c1ccccc1
CCCN(CC1CCOC1)C(=O)c1ccc2oc(NCc3cccc(Cl)c3)nc2c1
CCCN(CC1CCOC1)C(=O)c1cc(Cl)c2oc(NCc3cccc(Cl)c3)nc2c1
CCCN(CC1CCOC1)C(=O)c1cc(C)c2oc(NCc3cccc(Cl)c3)nc2c1
CCCN(CC1CCOC1)C(=O)c1cc(CC)c2oc(NCc3cccc(Cl)c3)nc2c1
CCCN(CC1CCOC1)C(=O)c1cc(CCC)c2oc(NCc3cccc(Cl)c3)nc2c1
Clc1cccc(CNC(=O)c2ccc3cn(CCN4CCOC4=O)nc3c2)c1
Cc1cc(OCC(O)=O)cc(C)c1Cc1ccc(O)cc1
CC(C)c1cc(Cc2c(C)cc(OCC(O)=O)cc2C)ccc1N
COc1ccc(Oc2c(Cl)cc(NC(=O)Cc3cnn(c3)S(C)(=O)=O)cc2Cl)cc1C(C)C
CC(C)c1cc(ccc1OC)Oc2c(cc(cc2Cl)NC(=O)Cc3cccnc3)Cl
COc1ccc(Oc2c(Cl)cc(NC(=O)Cc3ccncc3)cc2Cl)cc1C(C)C
COc1ccc(Oc2c(Cl)cc(NC(=O)Cc3ccccc3)cc2Cl)cc1C(C)C
CC(C)c1cc(ccc1OC)Oc2c(cc(cc2Cl)CO)Cl
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1ccc(cc1)C(N)=N
N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)NCc1cccc(Cl)c1
Cc1c2cc(ccc2c(c(n1)C(=O)NCC(=O)O)O)Oc3ccccc3
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccccc3)cc12
CCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccccc3)cc12
OC(=O)CNC(=O)c1nc(Cl)c2cc(Oc3ccccc3)ccc2c1O
OC(=O)CNC(=O)c1nc(Br)c2cc(Oc3ccccc3)ccc2c1O
CN(C)Cc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccccc3)cc12
COCCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccccc3)cc12
OC(=O)CNC(=O)c1nc(OC2CCC2)c2cc(Oc3ccccc3)ccc2c1O
COc1c2cc(ccc2c(c(n1)C(=O)NCC(=O)O)O)Oc3ccc(cc3)Cc4ccccc4
CCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(Cc4ccccc4)cc3)cc12
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(cc3)-c3ccccc3)cc12
CCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(cc3)-c3ccccc3)cc12
COc1c2cc(ccc2c(c(n1)C(=O)NCC(=O)O)O)Oc3ccc(cc3)Oc4ccccc4
CCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(Oc4ccccc4)cc3)cc12
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(cc3)C(=O)c3ccccc3)cc12
CCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(cc3)C(=O)c3ccccc3)cc12
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(cc3)C(C)(C)c3ccccc3)cc12
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3ccc(CCc4ccccc4)cc3)cc12
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3c(C)cc(Cc4ccccc4)cc3C)cc12
Cc1cc(cc(c1Oc2ccc3c(c2)c(nc(c3O)C(=O)NCC(=O)O)OC)C)C(=O)c4ccccc4
Cc1cccc(c1)C(=O)c2cc(c(c(c2)C)Oc3ccc4c(c3)c(nc(c4O)C(=O)NCC(=O)O)OC)C
CCOc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3c(C)cc(cc3C)C(=O)c3cccc(C)c3)cc12
COc1nc(C(=O)NCC(O)=O)c(O)c2ccc(Oc3c(C)cc(cc3C)C(=O)c3cc(C)cc(C)c3)cc12
CCOc1c2cc(ccc2c(c(n1)C(=O)NCC(=O)O)O)Oc3c(cc(cc3C)C(=O)c4cc(cc(c4)C)C)C
COc1cc(F)cc(c1)C(=O)c1cc(C)c(Oc2ccc3c(O)c(nc(OC)c3c2)C(=O)NCC(O)=O)c(C)c1
CCOc1c2cc(ccc2c(c(n1)C(=O)NCC(=O)O)O)Oc3c(cc(cc3C)C(=O)c4cc(cc(c4)F)OC)C
CC(C)(O)c1ccc(NC(=O)c2cc(C(=O)NCc3ccc(F)c(F)c3)c(F)cc2Cl)cc1
Cc1cc(ccc1NC(=O)c2cc(c(cc2Cl)F)C(=O)NCc3ccc(cc3)F)OC(F)F
Cc1cc(cnc1NC(=O)c2cc(c(cc2Cl)F)C(=O)NCc3ccc(c(c3)F)F)N4CCOCC4
Oc1cccc2n(ccc12)-c1c(Cl)cc(cc1Cl)-n1nc(C#N)c(=O)[nH]c1=O |(-4.17,-7.23,;-4.17,-5.68,;-5.49,-4.99,;-5.49,-3.44,;-4.17,-2.67,;-2.78,-3.44,;-1.39,-2.98,;-.46,-4.21,;-1.39,-5.45,;-2.78,-4.99,;-.93,-1.51,;-1.93,-.35,;-3.4,-.66,;-1.47,1.12,;.08,1.43,;1.08,.27,;.62,-1.2,;1.62,-2.28,;.54,2.9,;2.01,3.21,;2.47,4.68,;4.02,4.99,;5.49,5.29,;1.47,5.76,;1.93,7.23,;,5.45,;-.46,3.98,;-2.01,3.67,)|
Oc1ccc2ccn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2c1 |(-6.21,-3.47,;-4.88,-4.26,;-4.88,-5.74,;-3.55,-6.52,;-2.23,-5.74,;-.74,-6.29,;.2,-5.04,;-.74,-3.79,;-.27,-2.3,;-1.29,-1.13,;-2.85,-1.44,;-.82,.35,;.66,.66,;1.76,-.51,;1.21,-1.99,;2.3,-3.08,;1.13,2.15,;2.69,2.46,;3.16,3.94,;4.65,4.26,;6.21,4.57,;2.15,5.04,;2.62,6.52,;.59,4.72,;.12,3.32,;-1.37,2.93,;-2.23,-4.26,;-3.55,-3.47,)|
CCn1c2ccn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2ccc1=O |(-4.84,-7.67,;-3.52,-6.89,;-3.52,-5.34,;-2.21,-4.57,;-.74,-5.03,;.19,-3.79,;-.74,-2.56,;-.27,-1.08,;-1.28,,;-2.75,-.31,;-.81,1.47,;.66,1.78,;1.74,.7,;1.28,-.77,;2.28,-1.94,;1.2,3.25,;2.67,3.56,;3.14,5.03,;4.61,5.34,;6.16,5.65,;2.13,6.19,;2.59,7.67,;.58,5.88,;.12,4.41,;-1.36,4.1,;-2.21,-3.02,;-3.52,-2.25,;-4.84,-3.02,;-4.84,-4.57,;-6.16,-5.34,)|
FC(F)(F)Cn1c2ccn(-c3c(Cl)cc(cc3Cl)-n3nc(C#N)c(=O)[nH]c3=O)c2ccc1=O |(-6.15,-6.15,;-4.83,-6.92,;-6.15,-7.69,;-4.83,-8.39,;-3.44,-6.15,;-3.44,-4.6,;-2.13,-3.83,;-.66,-4.29,;.19,-3.05,;-.66,-1.82,;-.19,-.35,;-1.28,.73,;-2.74,.43,;-.73,2.2,;.73,2.51,;1.74,1.43,;1.28,-.04,;2.28,-1.2,;1.2,3.98,;2.67,4.29,;3.21,5.76,;4.68,6.07,;6.15,6.38,;2.13,6.92,;2.59,8.39,;.66,6.61,;.19,5.14,;-1.35,4.83,;-2.13,-2.28,;-3.44,-1.51,;-4.83,-2.28,;-4.83,-3.83,;-6.15,-4.6,)|
Clc1cc(cc(Cl)c1-n1ccc2n(C3CCC3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(-2.84,.43,;-1.28,.74,;-.82,2.22,;.66,2.53,;1.67,1.36,;1.21,-.04,;2.29,-1.21,;-.27,-.35,;-.74,-1.83,;.12,-3.07,;-.74,-4.32,;-2.22,-3.85,;-3.54,-4.63,;-3.54,-6.18,;-2.45,-7.27,;-3.54,-8.36,;-4.63,-7.27,;-4.86,-3.85,;-6.18,-4.63,;-4.86,-2.29,;-3.54,-1.59,;-2.22,-2.29,;1.13,4.01,;2.68,4.32,;3.15,5.79,;4.63,6.11,;6.18,6.42,;2.14,6.96,;2.61,8.36,;.58,6.65,;.12,5.17,;-1.36,4.86,)|
Clc1cc(cc(Cl)c1-n1ccc2n(C3CCCC3)c(=O)ccc12)-n1nc(C#N)c(=O)[nH]c1=O |(-2.74,.46,;-1.28,.77,;-.81,2.24,;.73,2.55,;1.74,1.47,;1.28,,;2.28,-1.16,;-.27,-.31,;-.73,-1.78,;.19,-3.01,;-.73,-4.25,;-2.13,-3.79,;-3.52,-4.56,;-3.52,-6.11,;-2.28,-6.96,;-2.74,-8.42,;-4.29,-8.42,;-4.75,-6.96,;-4.83,-3.79,;-6.14,-4.56,;-4.83,-2.24,;-3.52,-1.47,;-2.13,-2.24,;1.2,4.02,;2.67,4.33,;3.13,5.8,;4.68,6.11,;6.14,6.42,;2.13,6.96,;2.59,8.42,;.66,6.65,;.19,5.18,;-1.35,4.87,)|
CC(C)n1c2ccn(-c3c(Cl)cc(NC(=O)CC(O)=O)cc3Cl)c2ccc1=O |(-2.21,-6.36,;-3.61,-5.59,;-4.93,-6.36,;-3.61,-4.03,;-2.21,-3.26,;-.81,-3.72,;.12,-2.48,;-.81,-1.24,;-.27,.15,;-1.36,1.32,;-2.83,1.01,;-.89,2.79,;.66,3.1,;1.12,4.58,;2.6,4.89,;2.99,6.36,;3.69,3.8,;5.16,4.19,;6.25,3.1,;5.62,5.66,;1.67,1.94,;1.2,.54,;2.21,-.62,;-2.21,-1.71,;-3.61,-1.01,;-4.93,-1.71,;-4.93,-3.26,;-6.25,-4.03,)|
CC(C)n1c2ccn(-c3c(Cl)cc(cc3Cl)-c3n[nH]c(=O)[nH]c3=O)c2ccc1=O |(-.66,-7.64,;-1.98,-6.94,;-3.37,-7.64,;-1.98,-5.39,;-.66,-4.62,;.81,-5.08,;1.67,-3.84,;.81,-2.6,;1.28,-1.12,;.19,.04,;-1.28,-.35,;.74,1.44,;2.21,1.82,;3.22,.66,;2.75,-.81,;3.76,-1.98,;2.68,3.22,;4.15,3.53,;4.69,5,;3.61,6.17,;4.07,7.64,;2.13,5.86,;1.67,4.38,;.12,4.07,;-.66,-3.06,;-1.98,-2.29,;-3.37,-3.06,;-3.37,-4.62,;-4.69,-5.39,)|
CCc1c(c(nn1-c1ccccc1-c1cccc(OCC(O)=O)c1)-c1ccccc1)-c1ccccc1
OC(=O)Cc1ccc(cc1)-c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C2CC2)cc1 |(-8.72,6.29,;-7.62,5.2,;-8.01,3.71,;-6.14,5.59,;-5.04,4.5,;-3.56,4.89,;-2.46,3.79,;-2.85,2.31,;-4.34,1.92,;-5.43,3.01,;-1.76,1.21,;-.27,1.6,;.82,.51,;.43,-.98,;1.52,-2.07,;3.01,-1.6,;4.18,-2.62,;4.03,-4.18,;5.43,-4.81,;6.45,-3.64,;5.67,-2.31,;6.29,-.9,;5.36,.35,;3.87,.2,;5.98,1.76,;7.54,1.92,;8.48,.66,;7.86,-.74,;8.72,-1.99,;2.62,-4.96,;1.92,-6.29,;1.13,-4.96,;-1.06,-1.37,;-2.15,-.27,)|
C[C@](O)(CN1CC2CC(C1)N2c1ccc(C#N)cc1)C(=O)Nc1cnc(C#N)c(C(F)(F)F)c1
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(CN)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(C(N)=O)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(C(=O)O)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(CO)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
COCc1nn(-c2cc(Cl)c(Oc3cc(C(C)C)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
CNCc1nn(-c2cc(Cl)c(Oc3cc(C(C)C)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(CN(C)C)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(Cn4ccnc4)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(NC(=O)OC(C)(C)C)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)C1=CC(=NNC1=O)Oc2c(cc(cc2Cl)N3C(=O)NC(=O)C(=N3)N)Cl
CNc1nn(-c2cc(Cl)c(Oc3cc(C(C)C)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(N(C)C)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(-c4ccccn4)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(CC(=O)O)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
CC(C)c1cc(Oc2c(Cl)cc(-n3nc(CC#N)c(=O)[nH]c3=O)cc2Cl)n[nH]c1=O
C#Cc1nn(-c2cc(Cl)c(Oc3cc(C(C)C)c(=O)[nH]n3)c(Cl)c2)c(=O)[nH]c1=O
CC(C)CN(c1ccc(-c2ccc(OCC(=O)O)c(F)c2)cc1)S(=O)(=O)c1c(Cl)cccc1Cl
Cc1cn(CCN2CCN(CC2)c2ccccc2-c2cc(cc(c2)C(=O)NCCCN2CCCC2)C#N)c2ccccc12