1497 SMILES Strings for C-X-C chemokine receptor type 3

Compound Name
SMILES String
CCOc1ncc(cn1)-c1cc(sc1C1CNCC(C)N1C(=O)Cn1cnc(n1)C(C)C)C(F)(F)F
CCOc1ncc(cn1)-c1cc(sc1C1CNCC(C)N1C(=O)Cn1cnc(CC)n1)C(F)(F)F
CCOc1ncc(cn1)-c1cc(sc1C1CNCC(C)N1C(=O)Cn1cnc(n1)C(C)(C)C)C(F)(F)F
CCOc1ncc(cn1)-c1cc(sc1C1CNCC(C)N1C(=O)Cn1cnc(COC)n1)C(F)(F)F
CC1CNCC(N1C(=O)Cn1cnc(n1)C(N)=O)c1sc(cc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CCc1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CC(C)c1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CC1CNCC(N1C(=O)Cn1cnc(n1)C(C)(C)C)c1sc(cc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
COCc1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CC1CNCC(N1C(=O)Cn1cnc(CO)n1)c1sc(cc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CCCc1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CC1CNCC(N1C(=O)Cn1cnc(CCO)n1)c1sc(cc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC1CNCC(N1C(=O)Cn1cnc(n1)C(C)(C)O)c1sc(cc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC(C)c1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C2CCO2)C(F)(F)F)n1
CCc1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C2CC2)C(F)(F)F)n1
CC(C)c1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C2CC2)C(F)(F)F)n1
CC1CNCC(N1C(=O)Cn1cnc(n1)C(C)(C)C)c1sc(cc1-c1cnc(nc1)C1CC1)C(F)(F)F
COCc1ncn(CC(=O)N2C(C)CNCC2c2sc(cc2-c2cnc(nc2)C2CC2)C(F)(F)F)n1
CCOc1ncc(cn1)-c1cc(sc1C1CNCC(C)N1C(=O)Cn1cnc(C)n1)C(F)(F)F
CC1CNCC(N1C(=O)Cn1cnc(C)n1)c1sc(cc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC1CNCC(N1C(=O)Cn1cnc(C)n1)c1sc(cc1-c1cnc(nc1)C1CC1)C(F)(F)F
CNC(=O)c1cccc(NC2C(NC(c3ccc(C)o3)C3(C)CCCO3)C(=O)C2=O)c1O
CN(C)C(=O)c1cccc(Nc2c(NC(C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1O
COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(NC(C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1O |r|
CN(C)S(=O)(=O)c1cccc(Nc2c(NC(C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1C
CN(CC(F)(F)F)C(=O)c1cccc(Nc2c(N[C@H](C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1O |r,w:19.23|
COC(=O)CN(C)C(=O)c1cccc(Nc2c(N[C@H](C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1O |r,w:19.23|
COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(NC(C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1O |r,w:21.21|
CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(C3CCCS3)c3ccc(C)o3)c(=O)c2=O)c1O |w:20.21|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1ncc(Cn2cccn2)s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc(cs1)C(F)(F)F)C(F)(F)F
CCc1csc(n1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nc(C)cc1C
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc(cs1)C(C)(C)C)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc(cs1)-c1ccccn1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1ncc(Cl)s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc(cs1)C#N)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1ncc(s1)C#N)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc2ccc(C)cc2s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc2ccc(F)cc2s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc2ccc(cc2s1)C#N)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc2ccccc2o1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)N(C)C)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1ncc(Br)cn1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)C1CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1ccc(c2CCN(Cc12)c1ccccc1)C(F)(F)F
COc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
COc1cccc(c1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
COc1nc(OC)nc(n1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1ccc(c2CCN(Cc12)c1ccc(Cl)cc1)C(F)(F)F
CCCc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
COc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C
COc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nc(C)cc1C
COc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1cccn1
COc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nccn1
COc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)CCn1cccn1
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN(CC1)C(=O)Cn1cnc2cccnc12
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN(CC1)C(=O)Cn1nc(C)cc1C
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN(CC1)C(=O)Cn1nc(C)nc1C
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN(CC1)C(=O)Cn1ncc2cccnc12
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN(CC1)C(=O)Cn1cc2cccnc2n1
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN(CC1)C(=O)CN1C(=O)Cc2ccccc12
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@@H](C)C1)C(=O)Cn1cnc2cccnc12
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@@H](C)C1)C(=O)Cn1nc(C)cc1C
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@@H](C)C1)C(=O)Cn1ccc(C)n1
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@@H](C)C1)C(=O)CN1CCc2cccnc12
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(c2CCN(Cc12)c1nc2ccc(F)cc2s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ncc2cccnc12)c1ccc(c2CCN(Cc12)c1nc2ccc(F)cc2s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ccc(C)n1)c1ccc(c2CCN(Cc12)c1nc2ccc(F)cc2s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nccc1C)c1ccc(c2CCN(Cc12)c1nc2ccc(F)cc2s1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(c2CCN(Cc12)c1nc(cs1)C(F)(F)F)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ncc2cccnc12)c1ccc(c2CCN(Cc12)c1nc(cs1)C(F)(F)F)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ccc(C)n1)c1ccc(c2CCN(Cc12)c1nc(cs1)C(F)(F)F)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nccc1C)c1ccc(c2CCN(Cc12)c1nc(cs1)C(F)(F)F)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)C1CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ncc2cccnc12)c1ccc(c2CCN(Cc12)c1cnc(nc1)C1CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ccc(C)n1)c1ccc(c2CCN(Cc12)c1cnc(nc1)C1CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nccc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)C1CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)N(C)C)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ccc(C)n1)c1ccc(c2CCN(Cc12)c1cnc(nc1)N(C)C)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nccc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)N(C)C)C(F)(F)F
CNc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1ncc2cccnc12
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C
CCOc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nc(C)cc1C
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1ncc(o1)-c1ccccc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)cc1C)c1ccc(c2CCN(Cc12)c1nc2ccccc2s1)C(F)(F)F
CCc1ncc(cn1)N1CCc2c(C1)c(ccc2C(F)(F)F)N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(c2CCN(Cc12)c1cnc(nc1)C(F)(F)F)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)OCc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)C1CC1
COc1ccc(cc1)C(=O)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)Cc1cccnc1
COc1ccc(CCC(=O)N2CCc3cccc(N4CCN([C@H](C)C4)C(=O)Cn4cnc5cccnc45)c3C2)cc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1cocn1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)Cn1ccc2ccccc12
CC(C)C(=O)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
COCC(=O)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)C1CCCC1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)C1CCCCC1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)[C@@H]1CCCc2ccccc12
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccc(C)cc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccc(Cl)cc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccc(Cl)c(Cl)c1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1cccc(c1)N(C)C
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccc(cc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCNC(C(=O)Cc3ccccc3)c12
C[C@@H](C(=O)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1)c1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)C1(CC1)c1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)COc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)CCc1ccc(Cl)cc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)CCc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)CCc1ccc(Cl)c(Cl)c1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccc2ncccc2c1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)Cn1cnc2ccccc12
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)Cn1cccn1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)CN1CCOCC1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)C(=O)c1ccnn1C
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(C)cn1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(F)cn1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(C)nc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(Cl)cc1
COc1ccccc1N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(cc1)C#N
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(cc1)C(F)(F)F
COc1cccc(c1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(OC(F)(F)F)cc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(F)cc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(nc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ncccn1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ccc(cn1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)C1N(CCc2ccccc12)c1ccccn1
COc1ccc(cc1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1cncnc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1cnc(nc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ncc(C)cn1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1cnc(C)nc1
CCCc1ncc(cn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
CC(C)Oc1ncc(cn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1cnc(OCC(F)(F)F)nc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1nccs1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1nc(C)cs1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1ncc(s1)-c1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1nc(C)c(C)s1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1nc(cs1)C#N
COc1ncc(cn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
COc1ccc(nn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
COc1cncc(n1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
COc1nc(OC)nc(n1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
COc1nccc(n1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
CCOc1ncc(cn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc12)c1nc(cs1)-c1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cccc2CCN(Cc12)c1cnc(nc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cccc2CCN(Cc12)c1cnc(nc1)C1CC1
CCOc1ncc(cn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3nc(C)nc3C)c2C1
CCOc1ncc(cn1)N1CCc2cccc(N3CCN([C@H](C)C3)C(=O)Cn3nc(C)cc3C)c2C1
CCOc1ncc(cn1)N1CCc2c(F)ccc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1
CCOc1ncc(cn1)N1CCc2c(F)ccc(N3CCN([C@H](C)C3)C(=O)Cn3nc(C)cc3C)c2C1
CCOc1ncc(cn1)N1CCc2c(F)ccc(N3CCN([C@H](C)C3)C(=O)Cn3nc(C)nc3C)c2C1
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(F)c2CCN(Cc12)c1cnc(nc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1ccc(F)c2CCN(Cc12)c1cnc(nc1)C1CC1
CCOc1ncc(cn1)N1CCc2cc(cc(N3CCN([C@H](C)C3)C(=O)Cn3cnc4cccnc34)c2C1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cccn1)c1cccc2CCN(Cc12)C(=O)Oc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cccc2CCN(Cc12)C(=O)OCc1ccccc1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1cccc2CCN(Cc12)C(=O)OCc1ccccc1
O=C(Cn1ccc2cccnc12)N1CCN(CC1)c1cccc2CCN(Cc12)C(=O)OCc1ccccc1
Cn1c2ccccc2n(CC(=O)N2CCN(CC2)c2cccc3CCN(Cc23)C(=O)OCc2ccccc2)c1=O
Cn1c2ccccc2n(CC(=O)N2CCN(CC2)c2cccc3CCN(Cc23)C(=O)c2ccccc2)c1=O
Cn1c2ccccc2n(CC(=O)N2CCN(CC2)c2cccc3CCNC(C(=O)Cc4ccccc4)c23)c1=O
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1cccc2CCN(Cc12)S(=O)(=O)Cc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1cccc2CCN(Cc3ccc(Cl)cc3)Cc12
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1ccc(Br)c2CCN(Cc12)C(=O)OCc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1ccc(c2CCN(Cc12)C(=O)OCc1ccccc1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1ccc(C#N)c2CCN(Cc12)C(=O)Oc1ccccc1
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1cc(F)c(F)c2CCN(Cc12)c1cnc(nc1)C(F)(F)F
CCOC(=O)[C@H]1CCC(CN(Cc2ccc(OCCN3C(=O)CCC3=O)c(OC)c2)C(C)c2ccc3OCCc3c2)CC1 |r,wD:5.4,(8.89,-3.35,;7.4,-2.95,;6.31,-4.04,;6.71,-5.52,;8.2,-5.92,;5.62,-6.61,;4.13,-6.21,;3.04,-7.3,;3.44,-8.79,;2.35,-9.88,;2.35,-11.42,;3.69,-12.19,;5.02,-11.42,;5.02,-9.88,;6.36,-9.11,;7.69,-9.88,;9.02,-9.11,;10.36,-9.88,;11.69,-9.11,;13.02,-9.88,;14.49,-9.4,;15.26,-8.07,;15.39,-10.65,;14.49,-11.9,;13.02,-11.42,;11.69,-12.19,;7.69,-11.42,;9.02,-12.19,;10.36,-11.42,;6.36,-12.19,;1.02,-12.19,;1.02,-13.73,;-.31,-11.42,;-.31,-9.88,;-1.65,-9.11,;-2.98,-9.88,;-4.44,-9.4,;-5.35,-10.65,;-4.44,-11.9,;-2.98,-11.42,;-1.65,-12.19,;4.93,-9.19,;6.02,-8.1,)|
COc1cc(CN(CC2CC[C@@H](CC2)C(O)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r,wD:11.14,(5.33,-2.54,;4,-3.31,;2.67,-2.54,;1.33,-3.31,;,-2.54,;-1.33,-3.31,;-2.67,-2.54,;-2.67,-1,;-1.58,.09,;-1.98,1.58,;-.89,2.67,;.6,2.27,;1,.78,;-.09,-.31,;1.69,3.36,;1.29,4.85,;3.18,2.96,;-4,-3.31,;-4,-4.85,;-5.33,-2.54,;-5.33,-1,;-6.67,-.23,;-8,-1,;-9.47,-.52,;-10.37,-1.77,;-9.47,-3.01,;-8,-2.54,;-6.67,-3.31,;,-1,;1.33,-.23,;2.67,-1,;4,-.23,;5.33,-1,;6.67,-.23,;8,-1,;9.47,-.52,;10.24,.81,;10.37,-1.77,;9.47,-3.01,;8,-2.54,;6.67,-3.31,)|
COc1cc(CN(C[C@H]2CC[C@H](CC2)C(O)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r,wU:8.7,11.14,(5.33,-2.54,;4,-3.31,;2.67,-2.54,;1.33,-3.31,;,-2.54,;-1.33,-3.31,;-2.67,-2.54,;-2.67,-1,;-1.58,.09,;-1.98,1.58,;-.89,2.67,;.6,2.27,;1,.78,;-.09,-.31,;1.69,3.36,;1.29,4.85,;3.18,2.96,;-4,-3.31,;-4,-4.85,;-5.33,-2.54,;-5.33,-1,;-6.67,-.23,;-8,-1,;-9.47,-.52,;-10.37,-1.77,;-9.47,-3.01,;-8,-2.54,;-6.67,-3.31,;,-1,;1.33,-.23,;2.67,-1,;4,-.23,;5.33,-1,;6.67,-.23,;8,-1,;9.47,-.52,;10.24,.81,;10.37,-1.77,;9.47,-3.01,;8,-2.54,;6.67,-3.31,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r,wU:8.7,wD:17.18,11.14,(5.33,-2.54,;4,-3.31,;2.67,-2.54,;1.33,-3.31,;,-2.54,;-1.33,-3.31,;-2.67,-2.54,;-2.67,-1,;-1.58,.09,;-1.98,1.58,;-.89,2.67,;.6,2.27,;1,.78,;-.09,-.31,;1.69,3.36,;1.29,4.85,;3.18,2.96,;-4,-3.31,;-4,-4.85,;-5.33,-2.54,;-5.33,-1,;-6.67,-.23,;-8,-1,;-9.47,-.52,;-10.37,-1.77,;-9.47,-3.01,;-8,-2.54,;-6.67,-3.31,;,-1,;1.33,-.23,;2.67,-1,;4,-.23,;5.33,-1,;6.67,-.23,;8,-1,;9.47,-.52,;10.24,.81,;10.37,-1.77,;9.47,-3.01,;8,-2.54,;6.67,-3.31,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r,wU:17.18,8.7,wD:11.14,(5.33,-2.54,;4,-3.31,;2.67,-2.54,;1.33,-3.31,;,-2.54,;-1.33,-3.31,;-2.67,-2.54,;-2.67,-1,;-1.58,.09,;-1.98,1.58,;-.89,2.67,;.6,2.27,;1,.78,;-.09,-.31,;1.69,3.36,;1.29,4.85,;3.18,2.96,;-4,-3.31,;-4,-4.85,;-5.33,-2.54,;-5.33,-1,;-6.67,-.23,;-8,-1,;-9.47,-.52,;-10.37,-1.77,;-9.47,-3.01,;-8,-2.54,;-6.67,-3.31,;,-1,;1.33,-.23,;2.67,-1,;4,-.23,;5.33,-1,;6.67,-.23,;8,-1,;9.47,-.52,;10.24,.81,;10.37,-1.77,;9.47,-3.01,;8,-2.54,;6.67,-3.31,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r,wU:17.18,8.7,wD:11.14,(4.82,-2.54,;3.48,-3.31,;2.15,-2.54,;.82,-3.31,;-.52,-2.54,;-1.85,-3.31,;-3.19,-2.54,;-3.19,-1,;-2.1,.09,;-2.5,1.58,;-1.41,2.67,;.08,2.27,;.48,.78,;-.61,-.31,;1.17,3.36,;.77,4.85,;2.66,2.96,;-4.52,-3.31,;-4.52,-4.85,;-5.85,-2.54,;-5.85,-1,;-7.19,-.23,;-8.52,-1,;-9.85,-.23,;-8.52,-2.54,;-7.19,-3.31,;-.52,-1,;.82,-.23,;2.15,-1,;3.48,-.23,;4.82,-1,;6.15,-.23,;7.48,-1,;8.95,-.52,;9.72,.81,;9.85,-1.77,;8.95,-3.01,;7.48,-2.54,;6.15,-3.31,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r,wU:8.7,wD:17.18,11.14,(4.82,-2.54,;3.48,-3.31,;2.15,-2.54,;.82,-3.31,;-.52,-2.54,;-1.85,-3.31,;-3.19,-2.54,;-3.19,-1,;-2.1,.09,;-2.5,1.58,;-1.41,2.67,;.08,2.27,;.48,.78,;-.61,-.31,;1.17,3.36,;.77,4.85,;2.66,2.96,;-4.52,-3.31,;-4.52,-4.85,;-5.85,-2.54,;-5.85,-1,;-7.19,-.23,;-8.52,-1,;-9.85,-.23,;-8.52,-2.54,;-7.19,-3.31,;-.52,-1,;.82,-.23,;2.15,-1,;3.48,-.23,;4.82,-1,;6.15,-.23,;7.48,-1,;8.95,-.52,;9.72,.81,;9.85,-1.77,;8.95,-3.01,;7.48,-2.54,;6.15,-3.31,)|
C[C@H](N(C[C@H]1CC[C@@H](CC1)C(O)=O)Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)c1ccc(Cl)cc1 |r,wU:1.0,4.3,wD:7.10,(-4.52,-4.85,;-4.52,-3.31,;-3.19,-2.54,;-3.19,-1,;-2.1,.09,;-2.5,1.58,;-1.41,2.67,;.08,2.27,;.48,.78,;-.61,-.31,;1.17,3.36,;.77,4.85,;2.66,2.96,;-1.85,-3.31,;-.52,-2.54,;-.52,-1,;.82,-.23,;2.15,-1,;3.48,-.23,;4.82,-1,;6.15,-.23,;7.48,-1,;8.95,-.52,;9.72,.81,;9.85,-1.77,;8.95,-3.01,;7.48,-2.54,;6.15,-3.31,;2.15,-2.54,;3.48,-3.31,;.82,-3.31,;-5.85,-2.54,;-5.85,-1,;-7.19,-.23,;-8.52,-1,;-9.85,-.23,;-8.52,-2.54,;-7.19,-3.31,)|
C[C@H](N(C[C@H]1CC[C@H](CC1)C(O)=O)Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)c1ccc(Cl)cc1 |r,wU:1.0,4.3,7.10,(-4.52,-4.85,;-4.52,-3.31,;-3.19,-2.54,;-3.19,-1,;-2.1,.09,;-2.5,1.58,;-1.41,2.67,;.08,2.27,;.48,.78,;-.61,-.31,;1.17,3.36,;.77,4.85,;2.66,2.96,;-1.85,-3.31,;-.52,-2.54,;-.52,-1,;.82,-.23,;2.15,-1,;3.48,-.23,;4.82,-1,;6.15,-.23,;7.48,-1,;8.95,-.52,;9.72,.81,;9.85,-1.77,;8.95,-3.01,;7.48,-2.54,;6.15,-3.31,;2.15,-2.54,;3.48,-3.31,;.82,-3.31,;-5.85,-2.54,;-5.85,-1,;-7.19,-.23,;-8.52,-1,;-9.85,-.23,;-8.52,-2.54,;-7.19,-3.31,)|
C[C@@H](N(C[C@H]1CC[C@@H](CC1)C(O)=O)Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)c1ccc(Cl)cc1 |r,wU:4.3,wD:1.0,7.10,(-4.52,-4.85,;-4.52,-3.31,;-3.19,-2.54,;-3.19,-1,;-2.1,.09,;-2.5,1.58,;-1.41,2.67,;.08,2.27,;.48,.78,;-.61,-.31,;1.17,3.36,;.77,4.85,;2.66,2.96,;-1.85,-3.31,;-.52,-2.54,;-.52,-1,;.82,-.23,;2.15,-1,;3.48,-.23,;4.82,-1,;6.15,-.23,;7.48,-1,;8.95,-.52,;9.72,.81,;9.85,-1.77,;8.95,-3.01,;7.48,-2.54,;6.15,-3.31,;2.15,-2.54,;3.48,-3.31,;.82,-3.31,;-5.85,-2.54,;-5.85,-1,;-7.19,-.23,;-8.52,-1,;-9.85,-.23,;-8.52,-2.54,;-7.19,-3.31,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)C2CCc3cc(Cl)ccc23)ccc1OCCN1C(=O)CCC1=O |r,wU:8.7,wD:11.14,(5.16,-2.3,;3.82,-3.07,;2.49,-2.3,;1.16,-3.07,;-.18,-2.3,;-1.51,-3.07,;-2.85,-2.3,;-2.85,-.76,;-1.76,.33,;-2.15,1.82,;-1.07,2.91,;.42,2.51,;.82,1.02,;-.27,-.07,;1.51,3.6,;3,3.2,;1.11,5.08,;-4.18,-3.07,;-4.18,-4.61,;-5.64,-5.08,;-6.55,-3.84,;-8.08,-3.68,;-8.71,-2.27,;-10.19,-1.87,;-7.8,-1.02,;-6.27,-1.19,;-5.64,-2.59,;-.18,-.76,;1.16,.01,;2.49,-.76,;3.82,.01,;5.16,-.76,;6.49,.01,;7.82,-.76,;9.29,-.28,;10.06,1.05,;10.19,-1.53,;9.29,-2.77,;7.82,-2.3,;6.49,-3.07,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@@H]2CCc3cc(Cl)ccc23)ccc1OCCN1C(=O)CCC1=O |r,wU:8.7,wD:17.17,11.14,(5.16,-2.3,;3.82,-3.07,;2.49,-2.3,;1.16,-3.07,;-.18,-2.3,;-1.51,-3.07,;-2.85,-2.3,;-2.85,-.76,;-1.76,.33,;-2.15,1.82,;-1.07,2.91,;.42,2.51,;.82,1.02,;-.27,-.07,;1.51,3.6,;3,3.2,;1.11,5.08,;-4.18,-3.07,;-4.18,-4.61,;-5.64,-5.08,;-6.55,-3.84,;-8.08,-3.68,;-8.71,-2.27,;-10.19,-1.87,;-7.8,-1.02,;-6.27,-1.19,;-5.64,-2.59,;-.18,-.76,;1.16,.01,;2.49,-.76,;3.82,.01,;5.16,-.76,;6.49,.01,;7.82,-.76,;9.29,-.28,;10.06,1.05,;10.19,-1.53,;9.29,-2.77,;7.82,-2.3,;6.49,-3.07,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@H]2CCc3cc(Cl)ccc23)ccc1OCCN1C(=O)CCC1=O |r,wU:17.17,8.7,wD:11.14,(5.16,-2.3,;3.82,-3.07,;2.49,-2.3,;1.16,-3.07,;-.18,-2.3,;-1.51,-3.07,;-2.85,-2.3,;-2.85,-.76,;-1.76,.33,;-2.15,1.82,;-1.07,2.91,;.42,2.51,;.82,1.02,;-.27,-.07,;1.51,3.6,;3,3.2,;1.11,5.08,;-4.18,-3.07,;-4.18,-4.61,;-5.64,-5.08,;-6.55,-3.84,;-8.08,-3.68,;-8.71,-2.27,;-10.19,-1.87,;-7.8,-1.02,;-6.27,-1.19,;-5.64,-2.59,;-.18,-.76,;1.16,.01,;2.49,-.76,;3.82,.01,;5.16,-.76,;6.49,.01,;7.82,-.76,;9.29,-.28,;10.06,1.05,;10.19,-1.53,;9.29,-2.77,;7.82,-2.3,;6.49,-3.07,)|
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COc1cc(CN(C[C@@H]2CC[C@H](C2)C(O)=O)[C@@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@H]2CC[C@@H](C2)C(O)=O)[C@@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@H]2CC[C@H](C2)C(O)=O)[C@@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@@H]2CC[C@@H](C2)C(O)=O)[C@@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@H]2CC[C@H](C2)C(O)=O)[C@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@@H]2CC[C@H](C2)C(O)=O)[C@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@@H]2CC[C@H](C2)C(O)=O)[C@@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@@H]2CC[C@@H](C2)C(O)=O)[C@@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@H]2CC[C@H](C2)C(O)=O)[C@@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@@H]2CC[C@@H](C2)C(O)=O)[C@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@H]2CC[C@@H](C2)C(O)=O)[C@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C[C@H]2CC[C@@H](C2)C(O)=O)[C@@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
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COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@H]2CCc3cc(Cl)ccc23)ccc1OCCN1C(=O)[C@H]2CC=CC[C@H]2C1=O |r,wU:17.17,8.7,wD:11.14,41.46,36.39,c:42,(3.97,-2.3,;2.63,-3.07,;1.3,-2.3,;-.03,-3.07,;-1.37,-2.3,;-2.7,-3.07,;-4.03,-2.3,;-4.03,-.76,;-2.95,.33,;-3.34,1.82,;-2.25,2.91,;-.77,2.51,;-.37,1.02,;-1.46,-.07,;.32,3.6,;-.08,5.08,;1.81,3.2,;-5.37,-3.07,;-5.37,-4.61,;-6.83,-5.08,;-7.74,-3.84,;-9.27,-3.68,;-9.9,-2.27,;-11.38,-1.87,;-8.99,-1.02,;-7.46,-1.19,;-6.83,-2.59,;-1.37,-.76,;-.03,.01,;1.3,-.76,;2.63,.01,;3.97,-.76,;5.3,.01,;6.64,-.76,;6.8,-2.29,;5.46,-3.06,;8.3,-2.61,;9.07,-3.94,;10.61,-3.94,;11.38,-2.61,;10.61,-1.28,;9.07,-1.28,;8.04,-.13,;8.44,1.36,)|
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)[C@H]2CCc3cc(Cl)ccc23)ccc1OCCN1C(=O)c2ccccc2C1=O |r,wU:17.17,8.7,wD:11.14,(3.97,-2.3,;2.63,-3.07,;1.3,-2.3,;-.03,-3.07,;-1.37,-2.3,;-2.7,-3.07,;-4.03,-2.3,;-4.03,-.76,;-2.95,.33,;-3.34,1.82,;-2.25,2.91,;-.77,2.51,;-.37,1.02,;-1.46,-.07,;.32,3.6,;-.08,5.08,;1.81,3.2,;-5.37,-3.07,;-5.37,-4.61,;-6.83,-5.08,;-7.74,-3.84,;-9.27,-3.68,;-9.9,-2.27,;-11.38,-1.87,;-8.99,-1.02,;-7.46,-1.19,;-6.83,-2.59,;-1.37,-.76,;-.03,.01,;1.3,-.76,;2.63,.01,;3.97,-.76,;5.3,.01,;6.64,-.76,;8.04,-.13,;8.44,1.36,;9.07,-1.28,;10.61,-1.28,;11.38,-2.61,;10.61,-3.94,;9.07,-3.94,;8.3,-2.61,;6.8,-2.29,;5.46,-3.06,)|
CN1CC(=O)N(CCOc2ccc(CN(C[C@H]3CC[C@@H](CC3)C(O)=O)[C@H]3CCc4c3ccc(Cl)c4F)cc2C)C1=O |r,wU:25.25,16.15,wD:19.22,(10.96,-1.53,;9.42,-1.53,;8.52,-2.77,;7.05,-2.3,;5.72,-3.07,;7.05,-.76,;5.72,.01,;4.39,-.76,;3.05,.01,;1.72,-.76,;.39,.01,;-.95,-.76,;-.95,-2.3,;-2.28,-3.07,;-3.62,-2.3,;-3.62,-.76,;-2.53,.33,;-2.92,1.82,;-1.84,2.91,;-.35,2.51,;.05,1.02,;-1.04,-.07,;.74,3.6,;.34,5.08,;2.23,3.2,;-4.95,-3.07,;-4.95,-4.61,;-6.41,-5.08,;-7.32,-3.84,;-6.41,-2.59,;-7.04,-1.19,;-8.57,-1.02,;-9.48,-2.27,;-10.96,-1.87,;-8.85,-3.68,;-9.94,-4.77,;.39,-3.07,;1.72,-2.3,;3.05,-3.07,;8.52,-.28,;8.92,1.2,)|
COc1cc(CN(CC2CC(C2)C(O)=O)[C@H]2CCc3cc(Cl)ccc23)ccc1OCCN1C(=O)CCC1=O |r,wU:15.15,(5.16,-1.98,;3.82,-2.75,;2.49,-1.98,;1.16,-2.75,;-.18,-1.98,;-1.51,-2.75,;-2.85,-1.98,;-2.85,-.44,;-1.76,.65,;-.22,.65,;-.22,2.19,;-1.76,2.19,;.87,3.28,;.47,4.77,;2.36,2.88,;-4.18,-2.75,;-4.18,-4.29,;-5.64,-4.77,;-6.55,-3.52,;-8.08,-3.36,;-8.71,-1.95,;-10.19,-1.55,;-7.8,-.71,;-6.27,-.87,;-5.64,-2.27,;-.18,-.44,;1.16,.33,;2.49,-.44,;3.82,.33,;5.16,-.44,;6.49,.33,;7.82,-.44,;9.29,.04,;9.69,1.52,;10.19,-1.21,;9.29,-2.46,;7.82,-1.98,;6.49,-2.75,)|
COc1cc(CN([C@H](C)c2ccc3CCCc3c2)[C@H]2C[C@H](C2)C(O)=O)ccc1OCCn1c(=O)ccn(C)c1=O |r,wU:18.19,20.24,wD:7.7,(5.19,-1.85,;3.85,-2.62,;2.52,-1.85,;1.18,-2.62,;-.15,-1.85,;-1.48,-2.62,;-2.82,-1.85,;-4.15,-2.62,;-4.15,-4.16,;-5.48,-1.85,;-5.48,-.31,;-6.82,.46,;-8.15,-.31,;-9.62,.16,;-10.52,-1.08,;-9.62,-2.33,;-8.15,-1.85,;-6.82,-2.62,;-2.82,-.31,;-3.91,.78,;-2.82,1.87,;-1.73,.78,;-2.82,3.41,;-4.15,4.18,;-1.48,4.18,;-.15,-.31,;1.18,.46,;2.52,-.31,;3.85,.46,;5.19,-.31,;6.52,.46,;7.85,-.31,;9.18,.47,;9.17,2.01,;10.52,-.31,;10.52,-1.85,;9.18,-2.64,;9.17,-4.18,;7.85,-1.85,;6.52,-2.61,)|
CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
CN(C)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
CC(C)(C)c1ncn(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
Cc1nc(C)n(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C1CC1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC(C)c1ncn(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C(F)(F)F)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](CO)C1)C(=O)Cn1cnc(n1)C(F)(F)F)C(F)(F)F
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](CO)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F
Cc1nc(C)n(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C2CC2)C(F)(F)F)n1
OC[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C(F)(F)F)c1sc(nc1-c1cnc(nc1)C1CC1)C(F)(F)F
CC(C)c1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2ccc(nc2)C(F)(F)F)C(F)(F)F)n1
CC(C)c1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
Cc1nc(C)n(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@H]1CN(CCN1C(=O)Cn1cnc2ccccc12)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
OC[C@H]1CN(CCN1C(=O)Cn1ccc2cc(F)ccc12)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
COc1ccc2n(CC(=O)N3CCN(C[C@@H]3CO)c3sc(nc3-c3cnc(nc3)C(F)(F)F)C(F)(F)F)ccc2c1
Cc1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
COCc1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
Cc1nc(no1)-c1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@H]1CN(CCN1C(=O)Cn1cnc(n1)-c1ccccc1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC(=O)c1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CC(O)c1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
Cc1ccn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@H]1CN(CCN1C(=O)Cn1cnc(n1)-c1ccccn1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CCc1nc(C)n(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CCc1nc(C)nn1CC(=O)N1CCN(C[C@@H]1CO)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
OC[C@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
Cc1nc(C)n(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OCC[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C(F)(F)F)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
OCC[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C1CCC1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC(C)(C)c1ncn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OCC[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C1CC1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CCc1ncn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CCc1ncnn1CC(=O)N1CCN(C[C@H]1CCO)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC(C)c1ncn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
Cc1ncn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
Cc1ncnn1CC(=O)N1CCN(C[C@H]1CCO)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
COCc1ncn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@H]1CN(CCN1C(=O)Cn1cnc(n1)C(F)F)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
Cc1ccn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CCc1ccn(CC(=O)N2CCN(C[C@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OCC[C@@H]1CN(CCN1C(=O)Cn1ccc(n1)C1CC1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
Cc1ccn(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
CCc1ccn(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1
OC[C@@H]1CN(CCN1C(=O)Cn1ccc(n1)C1CC1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F
CC1=CCC[C@H]1NC(=O)Nc1ccc(Cl)c(c1O)S(=O)(=O)[C@@]1(C)CCOC1 |r,t:1|
COc1cccc2n(Cc3cccc(CNC(=O)C(C)(C)O)c3)nc(NS(=O)(=O)c3ccc(Cl)s3)c12
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccc(cc1)C(F)(F)F
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccccc1C#N |(12.7,-2.6,;11.37,-3.37,;10.04,-2.6,;8.71,-3.37,;7.37,-2.62,;6.04,-3.39,;4.71,-2.63,;3.37,-3.4,;2.04,-2.63,;.71,-3.4,;.71,-4.94,;-.63,-2.63,;-1.96,-3.41,;-3.31,-2.65,;-4.65,-3.42,;-4.63,-4.96,;-5.98,-2.65,;-.65,-1.08,;.69,-.31,;-1.98,-.33,;-3.31,-1.11,;-4.65,-.34,;-6,-1.11,;-7.33,-.34,;-7.33,1.21,;-6,1.98,;-4.65,1.21,;-3.34,1.99,;-3.34,3.55,;-1.99,1.23,;-.67,2,;.68,1.23,;2.01,2.01,;2,3.55,;.65,4.32,;-.67,3.55,;-1.77,4.65,;-2.87,5.74,)|
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccc(C)cc1
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccc(OC)cc1
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccc(cc1)C#N
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1cccc(c1)C#N
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccccc1
CCCCCCCCCC(=O)N(CCN(C)C)C(C)c1nc2ccccc2c(=O)n1-c1ccc(O)cc1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1ccccc1-c1nc2ccccc2[nH]1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1ncccc1-c1nc2ccccc2[nH]1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1nnccc1-c1nc2ccccc2[nH]1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1ncsc1-c1nc2ccccc2[nH]1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1cccnc1-c1nc2ccccc2[nH]1
O=C(Cn1cnc2cccnc12)N1CCN(CC1)c1scnc1-c1nc2ccccc2[nH]1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1scnc1-c1nc2ccccc2[nH]1
C[C@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1scnc1-c1nc2ccccc2[nH]1
CC[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1scnc1-c1nc2ccccc2[nH]1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(C)nc1-c1nc2ccccc2[nH]1
CCc1nc(-c2nc3ccccc3[nH]2)c(s1)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
CC(C)c1nc(-c2nc3ccccc3[nH]2)c(s1)N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2ccccc2[nH]1)C1CC1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(CO)nc1-c1nc2ccccc2[nH]1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2ccccc2[nH]1)C1COC1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(CN(C)C)nc1-c1nc2ccccc2[nH]1
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
COc1ccc(cc1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F |r|
COc1ccc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F |r|
COc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1cnc(C)nc1)C(F)(F)F |r|
CCCc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1cnc(OCCN(C)C)nc1)C(F)(F)F |r|
COCCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2ccccc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1ccc2cccnc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1ccc2cnccc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1ncc2cccnc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)CN1C(=O)Cc2ccccc12)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1c2ccccc2oc1=O)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cccn1)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nccc1C)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1ccc(C)n1)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)cc1C)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1ccc(n1)C(F)(F)F)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc(n1)C(F)(F)F)C(F)(F)F |r|
CCOc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cc(Cl)cn1)C(F)(F)F |r|
COc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
CC(C)Oc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1cnc(OC2CCC2)nc1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1cnc(C)nc1)C(F)(F)F |r|
CCc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
CCCc1ncc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1cnc(nc1)C1CC1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1cnc(nc1)C(C)(C)C)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1cnc(nc1)N1CCCC1)C(F)(F)F |r|
COc1ccc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
CCOc1ccc(cn1)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1nc(C)nc1C)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1ccc(nc1)C(F)(F)F)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(Br)nc1-c1nc2ccccc2[nH]1
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
Cn1c(CN2CCN(CC2)c2ccccc2NC(=O)c2ccco2)nc2ccccc12
Clc1cccc(c1)C(=O)Nc1ccccc1N1CCN(CC1)C(=O)Cn1cnc2cccnc12
Clc1cccc(c1)C(=O)Nc1cccnc1N1CCN(CC1)C(=O)Cn1cnc2cccnc12
Clc1cccc(c1)C(=O)Nc1ncccc1N1CCN(CC1)C(=O)Cn1cnc2cccnc12
C[C@@H]1CN(CCN1C(=O)Cc1cccc2cccnc12)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cc1ccc(C)nc1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cccn1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cc(Cl)cn1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cc1nnc(C)o1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cc(CN(C)C)c(C)n1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1ccc(n1)C(O)=O)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc2CN(C)CCc12)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1c2ncccc2[nH]c1=O)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
COC1CCN(CC(=O)N2CCN(C[C@H]2C)c2sc(nc2-c2nc3ccccc3[nH]2)C(F)(F)F)C1 |r|
C[C@@H]1CN(CCN1C(=O)CN1CCC(F)(F)CC1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cc(cn1)C1CCN(C)CC1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)CN1[C@H](COC1=O)c1ccccc1)c1sc(nc1-c1nc2ccccc2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cccn1)c1sc(nc1-c1nc2ccccc2n1C)C(F)(F)F
COCCn1c(nc2ccccc12)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cccn1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2c(F)cccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2cccc(C)c2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2c(cccc2[nH]1)C(F)(F)F)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2cc(Cl)ccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2ccc(OC(F)(F)F)cc2[nH]1)C(F)(F)F |r|
COc1cc2nc([nH]c2cc1OC)-c1nc(sc1N1CCN([C@H](C)C1)C(=O)Cn1cnc2cccnc12)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2ccc(CO)cc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)C1CCOCC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cnc2cccnc12)c1sc(nc1-c1nc2cc(OCCO)ccc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(OC3COC3)cc2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)S(C)(=O)=O)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)-c1noc(C)n1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)-n1cncn1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)C1CCN(C)CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1cccn1)c1sc(nc1-c1nc2ccc(cc2[nH]1)N1CCN(C)CC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)N1CCOCC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(cc2[nH]1)C1CCNCC1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(OC3CNC3)cc2[nH]1)C(F)(F)F
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(O)c(F)c2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(c(F)c2[nH]1)C(C)(C)O)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2ccc(N3CCOCC3)c(F)c2[nH]1)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1nc(C)nc1C)c1sc(nc1-c1nc2cc(cc(F)c2[nH]1)N1CCOCC1)C(F)(F)F |r|
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NC(C)C
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccc(F)cc1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCC1CC1
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(OC)c(OC)c1
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccccc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccncc1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(F)cc1
COC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CC(C)NC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccs1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(c1)C#N)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccccc1
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccco1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccsc1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(F)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccccc1F)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCc1ccc(Cl)cc1
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1
CN(C)C(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccc(F)c(F)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccnc1)C(=O)NCCc1ccc(Cl)cc1Cl
CCCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccccc1Cl)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(OC)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccccc1F
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCc1ccccc1
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cc(F)cc(F)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1ccccc1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1cccc(F)c1
CCOC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1cccc(Cl)c1
CCCCNC(=O)N1CCCN(CC1)c1ccc(cc1NC(=O)c1cccc(Cl)c1)C(=O)NCCc1ccc(Cl)cc1Cl
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1ccccc1)=CC2 |c:26|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(OC3CCOC3)c1)=CC2 |w:25.26,c:34|
CC(=O)c1cccc(NC(=O)NC2CCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)c1 |t:17|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(F)c1)=CC2 |c:28|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1ccc(s1)-c1ccc(cc1)C(F)(F)F)=CC2 |c:36|
Fc1cc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)cc(c1)C(F)(F)F |t:13|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cccc(OC(F)(F)F)c1)=CC2 |c:31|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cc(ccc1F)C(F)(F)F)=CC2 |c:31|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)=CC2 |c:34|
O=C(NC1CCN(C\C2=C\CCCCCC2)CC1)Nc1ccc2ccccc2c1 |t:8|
CC1(C)C2CC1C(CCN1CCC(CC1)NC(=O)Nc1ccc3ccccc3c1)=CC2 |w:3.3,5.4,c:32|
CC1(C)[C@@H]2C[C@H]1C(C[N+]1(C)CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)=CC2 |c:32|
Clc1cncc(Cl)c1NC(=O)NC1CCN(C\C2=C\CCCCCC2)CC1 |t:18|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cccc(OC3CCOC3)c1)=CC2 |w:24.25,c:33|
Clc1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:15|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cccc(OC3CCOCC3)c1)=CC2 |c:34|
CC(=O)c1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:17|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cncc(Br)c1)=CC2 |c:27|
FC(F)(F)c1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:18|
COC(=O)c1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:18|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cncc(c1)-c1ccsc1)=CC2 |c:32|
COc1cccc(c1)-c1ccc(NC(=O)NC2CCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)s1 |t:22|
O=C(NC1CCN(C\C2=C\CCCCCC2)CC1)Nc1ccc(s1)-c1ccccc1 |t:8|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1ccc(s1)-c1ccccc1Cl)=CC2 |c:33|
COC(=O)c1cccc(NC(=O)NC2CCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)c1 |t:18|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cncc(c1)-c1cccs1)=CC2 |c:32|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1ccc(OC(F)(F)F)cc1)=CC2 |c:31|
O=C(NC1CCN(CCc2ccccc2)CC1)Nc1ccc2ccccc2c1
FC(F)(F)Oc1cccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:19|
O=C(NC1CCN(CCCc2ccccc2)CC1)Nc1ccc2ccccc2c1
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1ccc(F)c(c1)C(F)(F)F)=CC2 |c:31|
FC(F)(F)c1cc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)cc(c1)C(F)(F)F |t:16|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1ccc(s1)-c1ccccc1)=CC2 |c:32|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)=CC2 |c:31|
O=C(NC1CCN(C\C2=C\CCCCCC2)CC1)Nc1ccc(Oc2ccccc2)cc1 |t:8|
Clc1cc(Cl)cc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)c1 |t:16|
CC(C)(C)c1ccc(NC(=O)NC2CCN(C\C3=C\CCCCCC3)CC2)cc1 |t:17|
COc1cccc(NC(=O)NC2CCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)c1 |t:16|
CCc1nc(C)n(CC(=O)N2CCN(C[C@H]2C)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CCc1nc(C)nn1CC(=O)N1CCN(C[C@H]1C)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc(C)n1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1ncnc1C)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
CCc1ncn(CC(=O)N2CCN(C[C@H]2C)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CCc1ncnn1CC(=O)N1CCN(C[C@H]1C)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
CCc1nncn1CC(=O)N1CCN(C[C@H]1C)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
CC(C)c1ncn(CC(=O)N2CCN(C[C@H]2C)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C(C)(C)C)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C(F)(F)F)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C#N)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc(n1)C(N)=O)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
COCc1ncn(CC(=O)N2CCN(C[C@H]2C)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
C[C@@H]1CN(CCN1C(=O)Cn1cnc(CO)n1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
CC(O)c1ncn(CC(=O)N2CCN(C[C@H]2C)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
C[C@@H]1CN(CCN1C(=O)Cn1ccc(C)n1)c1sc(nc1-c1cnc(nc1)C(F)(F)F)C(F)(F)F |r|
Cc1ncn(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CCc1ncn(CC(=O)N2CCN(C[C@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CCc1ncn(CC(=O)N2CCN(C[C@@H]2CO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
Cc1ncn(CC(=O)N2CCN(C[C@@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CCc1ncn(CC(=O)N2CCN(C[C@@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CC(C)c1ncn(CC(=O)N2CCN(C[C@@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
Cc1ccn(CC(=O)N2CCN(C[C@@H]2CCO)c2sc(nc2-c2cnc(nc2)C(F)(F)F)C(F)(F)F)n1 |r|
CC(=O)Nc1cccc(c1)C(C)=NNC(=O)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)cc1 |w:12.13|
Cc1ccc(cc1)-c1ccc2CCCC(=Cc2c1)C(=O)Nc1ccc(C[N+](C)(C)C2CCOCC2)cc1 |c:15|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc3ccccc3o1)=CC2 |c:27|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)n1cc(O)n(-c3cccc(c3)C(F)(F)F)c1=O)=CC2 |c:34|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2ccccc2s1 |t:7|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2c(Cl)cccc2s1 |t:7|
CCN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)C(=O)Nc1cccc(c1)C(F)(F)F |t:8|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)n1cc(O)n(-c3cc(cc(c3)C(F)(F)F)C(F)(F)F)c1=O)=CC2 |c:38|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)N1CCN(C1=O)c1cc(F)cc(c1)C(F)(F)F)=CC2 |c:34|
CCc1cccc(c1)-n1c(O)cn(C2CCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)c1=O |t:19|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc3ccccc3s1)=CC2 |c:27|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2cccc(Cl)c2s1 |t:7|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)n1cc(O)n(-c3cc(F)cc(c3)C(F)(F)F)c1=O)=CC2 |c:35|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc(cs1)-c1ccc(Cl)c(Cl)c1)=CC2 |c:31|
CSc1cccc(c1)-n1c(O)cn(C2CCN(CC3=CC[C@H]4C[C@@H]3C4(C)C)CC2)c1=O |t:19|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc(cs1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)=CC2 |c:37|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2cc(Cl)ccc2s1 |t:7|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2ccccc2o1 |t:7|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc3ccc(Br)cc3s1)=CC2 |c:28|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc3c(Br)cccc3s1)=CC2 |c:28|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2ccccc2[nH]1 |t:7|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc(ns1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)=CC2 |c:37|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)n1cc(O)n(-c3ccc(Cl)c(c3)C(F)(F)F)c1=O)=CC2 |c:35|
CCc1cccc(c1)N(C)C(=O)NC1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1 |t:19|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)N1CCN(C1=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)=CC2 |c:37|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)C(=O)Nc1cccc(c1)C(F)(F)F |t:7|
CC1(C)[C@@H]2C[C@H]1C(CN1CCC(CC1)Nc1nc(cs1)-c1ccccc1)=CC2 |c:29|
CN(C1CCN(CC2=CC[C@H]3C[C@@H]2C3(C)C)CC1)c1nc2ccc(Cl)cc2s1 |t:7|
Fc1cc(NC(=O)NC2CCN(CC3=CC4CCC(C3)N4C(=O)C3CC3)CC2)cc(c1)C(F)(F)F |w:18.18,15.14,t:13|
CC(C)(C)C(=O)N1C2CCCC1C=C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:7.39,11.12,t:13,TLB:4:6:13.36.12:10.8.9|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:4.36,8.9,t:10,TLB:1:3:10.33.9:7.5.6|
CC(C)Oc1cc(F)cc(NC(=O)NC2CCN(CC3=CC4CCCC(C3)N4C(C)=O)CC2)c1 |w:25.25,21.20,t:19,TLB:28:27:19.26.20:22.24.23|
CC(C)(C)C(=O)N1C2CCC1C=C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:7.38,10.11,t:12|
CC(=O)N1C2CCCC1C=C(CN1C3CCC1CC(C3)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:4.39,8.9,18.22,13.14,16.16,t:10,TLB:1:3:10.35.9:7.5.6,TEB:20:18:12:14.15|
CC(C)Oc1cccc(NC(=O)NC2CCN(CC3=CC4CCCC(C3)N4C(C)=O)CC2)c1 |w:24.24,20.19,t:18,TLB:27:26:18.25.19:21.23.22|
CC(=O)N1C2CCC1C=C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:4.35,7.8,t:9|
CC(C)(C)C(=O)N1CCC(CN2CCC(CC2)NC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)CC1
CC(=O)N1C2CCC1CC(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:9.10,7.8,4.35,TLB:1:3:9.8.32:5.6,TEB:10:9:5.6:3|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)NC(=O)Nc1cccc(c1)C(C)=O)C2 |t:10,TLB:1:3:10.31.9:7.5.6|
FC(F)(F)c1cc(NC(=O)NC2CCN(CCC3CCS(=O)(=O)C3)CC2)cc(c1)C(F)(F)F |w:17.16|
CCOC(=O)N1C2CCC1C=C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:6.37,9.10,t:11|
CC(=O)N1CCC(CN2CCC(CC2)NC(=O)Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)CC1
CC(C)C(=O)N1C2CCC1C=C(CN1CCC(CC1)NC(=O)Nc1cc(F)cc(c1)C(F)(F)F)C2 |w:6.37,9.10,t:11|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ccccn2c(=O)c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ccccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ccccc2n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2N(C)CCCc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ccccc2cc1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCOc1ccc(cc1)N2C(=O)c3cccnc3N=C2[C@@H](C)N(Cc4cccnc4)C(=O)Cc5ccc(cc5)OC(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2cc1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1cc2ccccc2nc1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2ccccc2nc1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nn2ccccc2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(N)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(C2)NS(C)(=O)=O |r,THB:29:27:5.4:1|
CCNC(=O)NC1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C2(C)C |r,TLB:5:6:10.9:32|
C[C@H]1CN(CCN1c1ncc(cc1F)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:28:27:23.24:29|
C[C@@H]1CN(CCN1c1ncc(cc1F)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:28:27:23.24:29|
C[C@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1O)C2(C)C |r,TLB:27:26:22.23:28|
C[C@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](C[C@@H]1O)C2(C)C |r,TLB:27:26:22.23:28|
C[C@H]1CN(CCN1c1ncc(cc1F)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](C[C@@H]1O)C2(C)C |r,TLB:28:27:23.24:29|
C[C@H]1CN(CCN1c1ncc(cc1F)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC11OCCO1)C2(C)C |r|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
C[C@H]1CN(CCN1c1ncc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:27:26:22.23:28|
C[C@H]1CN(CCN1c1ncc(cc1F)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](C[C@H]1O)C2(C)C |r,TLB:28:27:23.24:29|
C[C@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](C[C@H]1O)C2(C)C |r,TLB:27:26:22.23:28|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN([C@H](CO)C1)c1ncc(cc1F)C(F)(F)F)C(=O)C2 |r,THB:31:30:5.4:1|
C[C@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:27:26:22.23:28|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ncc(cc1F)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ncccc1C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1cc(ccn1)C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1cccc(n1)C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccccn1)C(=O)C2 |r,THB:24:23:5.4:1|
Cc1ccc(nc1)N1CCN(CC1)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:23:22:18.19:24|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)[N+]([O-])=O)C(=O)C2 |r,THB:27:26:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C#N)C(=O)C2 |r,THB:26:25:5.4:1|
CC(=O)c1ccc(nc1)N1CCN(CC1)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:25:24:20.21:26|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ncc(cc1[N+]([O-])=O)C(F)(F)F)C(=O)C2 |r,THB:31:30:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ncc(cc1Cl)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(c(Cl)n1)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1nc(Cl)c(cc1Cl)C(F)(F)F)C(=O)C2 |r,THB:30:29:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cc1)C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cc1F)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ncc(cn1)C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ncc(Br)cn1)C(=O)C2 |r,THB:25:24:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(nn1)C(F)(F)F)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1cc3ccccc3cn1)C(=O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1nc3ccccc3s1)C(=O)C2 |r,THB:27:26:5.4:1|
CC1CN(CCN1S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C)c1ccc(cn1)C(F)(F)F |r,TLB:17:16:12.13:18|
C[C@H]1CN([C@H](C)CN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:28:27:23.24:29|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1C[C@@H]3C[C@H]1CN3c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
C[C@@H]1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:27:26:22.23:28|
CCC1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:28:27:23.24:29|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(C(CO)C1)c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:30:29:5.4:1|
CC(C)C1CN(CCN1c1ccc(cn1)C(F)(F)F)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C |r,TLB:29:28:24.25:30|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(C(C1)c1ccccc1)c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:34:33:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)NC1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
CN(CCN(C)S(=O)(=O)C[C@]12CC[C@H](CC1=O)C2(C)C)c1ccc(cn1)C(F)(F)F |r,TLB:16:15:11.12:17|
CC1(C)[C@@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:28:27:1:4.5|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(F)C2 |r,THB:28:27:5.4:1|
CC1(O)C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C2(C)C |r,TLB:2:1:6.5:28,THB:0:1:6.5:28|
CC1(C)[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)CC2 |r|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C(O)C2 |r,THB:28:27:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C1(C2)OCCO1 |r|
CC(=O)NC1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C2(C)C |r,TLB:3:4:8.7:30|
CCNC1C[C@H]2CC[C@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(cn1)C(F)(F)F)C2(C)C |r,TLB:2:3:7.6:29|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCN(CC1)c1ccc(Br)cn1)C(=O)C2 |r,THB:25:24:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(CS(=O)(=O)N1CCC(CC1)Nc1ccc(cn1)C(F)(F)F)C(=O)C2 |r,THB:29:28:5.4:1|
Brc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)cc1
O=C1CCC(C2CCN(Cc3ccccc3)CC2)(C(=O)N1)c1ccccc1
Clc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)cc1
Fc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)cc1
Clc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)cc1Cl
Fc1cc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)ccc1Cl
FC(F)(F)c1cc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)ccc1Cl
Brc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccn2)cc1
Brc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2cccnc2)cc1
Brc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccncc2)cc1
Fc1ccc(cc1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
Fc1ccc(c(F)c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
COc1ccc(cc1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
COc1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
COc1ccc(cc1C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1)S(O)(=O)=O
Clc1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
OC(=O)c1ccc(cc1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
OC(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
NC(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
CNC(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
OCCCNC(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
Brc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2cccc(c2)C(=O)N2CCOCC2)cc1
CN(N1CCNCC1)C(=O)c1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
Nc1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
Oc1cccc(c1)C1(CCC(=O)NC1=O)C1CCN(Cc2ccc(Br)cc2)CC1
CN1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
CCN1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
CCCN1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
CC(C)N1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
COCCN1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
CSCN1C(=O)CCC(C2CCN(Cc3ccc(Br)cc3)CC2)(C1=O)c1ccccc1
CC(=O)N1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
CCOC(=O)N1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
Brc1ccc(CN2CCC(CC2)C2(CCCN(C2)C=O)c2ccccc2)cc1
FC(F)(F)C(=O)N1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
CCC(=O)N1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
Brc1ccc(CN2CCC(CC2)C2(CCCN(C2)C2CC2=O)c2ccccc2)cc1
NC(=O)CN1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
Brc1ccc(CN2CCC(CC2)C2(CCCN(C2)C(=O)Nc2ccccc2)c2ccccc2)cc1
NC(=O)N1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
NS(=O)(=O)N1CCCC(C1)(C1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1
Brc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2)c2ccccc2)cc1
Brc1ccc(CN2CCC(CC2)C2(CCCNC2)c2ccccc2)cc1
Brc1ccc(CN2CCC(CC2)C2(CCCNC2=O)c2ccccc2)cc1
Cc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)cc1
COc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)cc1
Clc1ccc(CN2CCC(CC2)C2(CCC(=O)NC2=O)c2ccccc2)c(Cl)c1
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)N(C)c1ccccc1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Oc1ccccc1 |r,c:21|
CCN(CC)C[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:20|
CCN(CC)C(=O)[C@@H]1CC2[C@@H](Cc3c[nH]c4cccc2c34)N(C1)C(=O)Nc1ccccc1 |r|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3cn(C)c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:22|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3cn(Cc4ccccc4)c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:29|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1C |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1cccc(C)c1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccc(C)cc1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccn1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1cccnc1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccncc1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1cc(OC)c(OC)c(OC)c1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)NC1CCCCC1 |r,c:21|
CCN(CC)C(=O)[C@H]1CN[C@@H]2Cc3c[nH]c4cccc(C2=C1)c34 |r,c:21|
CCN(CC)C(=O)[C@@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:21|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1 |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2c(OC)nccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2c(C)nccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCc1nccn2c(c(nc12)[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cc1ccc(c(F)c1)C(F)(F)F)-c1ccc(cc1)C#N |r|
CCS(=O)(=O)CCN(C(C)c1nc2c(nccn2c1-c1ccc(cc1)C#N)N(C)C)C(=O)Cc1ccc(c(F)c1)C(F)(F)F
CCS(=O)(=O)CCN(C(C)c1nc2n(cc[nH]c2=O)c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(OC(F)(F)F)cc1)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1cccc(c1)C(F)(F)F)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1cccc(OC(F)(F)F)c1)c1nc2c(nccn2c1-c1ccc(cc1)C#N)C1CC1 |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2nc(C)ccc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2nc(OC)ccc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2nc(OC)ccc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2nc(C)ccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCS(=O)(=O)CCN(C(C)c1nc2c(Cl)nccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F
CCOc1ccc2c(n1)nc(C(C)N(CCS(=O)(=O)CC)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)n(-c1ccc(cc1)C#N)c2=O
CCS(=O)(=O)CCN(C(C)c1nc2nc(OC(C)C)ccc2c(=O)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN(C(C)c1nc2nc(ccc2c(=O)n1-c1ccc(cc1)C#N)C(F)(F)F)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc2cnccn2c1-c1ccc(cc1)C#N)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc(cn1-c1ccc(cc1)C#N)-c1ccccc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2ccc(cc2)C#N)CC1)C(=O)NCCOc1ccccc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(CNC(=O)c3ccc(Cl)c(Cl)c3)cc2Cl)cc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ccc(cc2Cl)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1
Fc1ccc(CNC(=O)c2cnc(N3CCN(CC3)C3CCN(Cc4ccc(cc4)C#N)CC3)c(Cl)c2)cc1
Fc1ccc(CNC(=O)c2ccc(nc2)N2CCN(CC2)C2CCN(Cc3ccc(cc3)C#N)CC2)cc1
C[C@@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1 |r|
C[C@H]1CC(CCN1Cc1ccc(Cl)cc1)N1CCN(CC1)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN(CC2)C2CCN(Cc3ccc(Cl)cc3)[C@@H](C)C2)c(Cl)c1 |r|
Clc1ccc(CN2CCC(CC2)C2CCN(CC2)c2ncc(cc2Cl)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1
Clc1ccc(CN2CCN(CC2)C2CCN(CC2)c2ncc(cc2Cl)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1
CN(CCN(C)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1)C1CCN(Cc2ccc(Cl)cc2)CC1
CN(CCCN1CCN(CC1)c1ncc(cc1Cl)C(=O)NCCOc1ccccc1)c1ccc(Cl)cc1
Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2ccccc2)CC1)C(=O)NCCOc1ccccc1
Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2cccc(c2)C#N)CC1)C(=O)NCCOc1ccccc1
Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2ccccc2C#N)CC1)C(=O)NCCOc1ccccc1
Clc1cc(cnc1N1CCN(CC1)C1CCN(CC1)C(=O)c1ccc(cc1)C#N)C(=O)NCCOc1ccccc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCCOc2ccccc2)cc1
Clc1cc(cnc1N1CCN(CC1)C1CCN(Cc2ccc(Br)cc2)CC1)C(=O)NCCOc1ccccc1
Fc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCCOc2ccccc2)cc1
FC(F)(F)c1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCCOc2ccccc2)cc1
COc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCCOc2ccccc2)cc1
CN(C)c1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCCOc2ccccc2)cc1
CNC(=O)c1cnc(N2CCN(CC2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1
CCCCNC(=O)c1cnc(N2CCN(CC2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCc2ccccc2)cc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCCc2ccccc2)cc1
COc1cccc(CNC(=O)c2cnc(N3CCN(CC3)C3CCN(Cc4ccc(Cl)cc4)CC3)c(Cl)c2)c1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(cc2Cl)C(=O)NCc2ccc(Cl)c(Cl)c2)cc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(NC(=O)Cc3ccc(Cl)c(Cl)c3)cc2Cl)cc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(NC(=O)Nc3ccc(Cl)c(Cl)c3)cc2Cl)cc1
Clc1ccc(CN2CCC(CC2)N2CCN(CC2)c2ncc(CNCc3ccc(Cl)c(Cl)c3)cc2Cl)cc1
CN(Cc1ccc(Cl)c(Cl)c1)Cc1cnc(N2CCN(CC2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1
CN(c1ccccc1N(C)S(=O)(=O)c1ccc(C)cc1)S(=O)(=O)c1ccc(C)cc1
Cc1ccc(cc1)S(=O)(=O)N(CC=C)c1ccccc1N(CC=C)S(=O)(=O)c1ccc(C)cc1
CN(c1ccccc1C(=O)c1ccsc1)S(=O)(=O)c1ccc(C)cc1
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(C[C@H]1CCCN1C(C)C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(C[C@@H]1CCCN1C(C)C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(C[C@H]1CCCN1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(CC1CCN(C)CC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(C1CCN(CC1)C(C)C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(C1CCN(CC1)C(C)=O)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(C1CCOCC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(OCC(F)(F)F)cc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(Cc1ccc[n+]([O-])c1)C(=O)Cc1ccc(OC(F)(F)F)cc1 |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)CN1CCN(CCC(F)(F)F)CC1 |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1nc2ccc(cc2[nH]1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cn1cnc(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(cn1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)CCc1ccc(cc1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1cccc(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)cc1
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C#N |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(cc1)S(C)(=O)=O |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(F)c1 |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1cc(F)c(F)c(F)c1 |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)c(F)c1 |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2cnccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2cccnc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2nccnc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
CCOc1ccc(cc1)-n1c(nc2ncccc2c1=O)[C@@H](C)N(Cc1cc(C)no1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NC[C@@H]1CCCO1 |r|
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCC1CC1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCc1cccc(Cl)c1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCc1cccs1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NC1(CC1)c1ccccc1
[O-][N+](=O)c1cccc(CCNC(=O)c2ccc(CN(Cc3ccccc3)S(=O)(=O)c3ccc(Cl)cc3)cc2)c1
COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCC1CC1
COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCc1ccccc1
CCOc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCC1CC1
FC(F)(F)Oc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(=O)NCC1CC1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)NCC1CC1)Cc1ccccn1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)NCc1cccc(Cl)c1)Cc1ccccn1
COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)NCC1CC1)Cc1cccnc1
O=C(NCC1CC1)c1ccc(CN(Cc2ccccn2)S(=O)(=O)c2ccc(cc2)C#N)cc1
Fc1ccccc1CN(Cc1ccc(cc1)C(=O)NCC1CC1)S(=O)(=O)c1ccc(Cl)cc1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)NCC1CC1)Cc1cccc(Cl)c1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)NC1(CC1)c1ccccc1)Cc1ccccn1
O=C(NC1(CC1)c1ccccc1)c1ccc(CN(Cc2ccccn2)S(=O)(=O)c2ccc(cc2)C#N)cc1
OC(=O)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccc(Cl)cc2)cc1
COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(O)=O
OC(=O)c1ccc(CN(Cc2ccccn2)S(=O)(=O)c2ccc(Cl)cc2)cc1F
OC(=O)c1ccc(CN(Cc2ccccc2F)S(=O)(=O)c2ccc(Cl)cc2)cc1F
OC(=O)c1ccc(CN(Cc2ccccn2)S(=O)(=O)c2ccc(cc2)C#N)cc1F
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1n[nH]c(=O)o1)Cc1ccccn1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1nnn[nH]1)Cc1ccccn1
Fc1ccccc1CN(Cc1ccc(cc1)-c1nnn[nH]1)S(=O)(=O)c1ccc(Cl)cc1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1nnn[nH]1)Cc1cccc(Cl)c1
Clc1ccc(CN(Cc2ccc(cc2)-c2nnn[nH]2)S(=O)(=O)c2ccc(Cl)cc2)cc1
O=S(=O)(N(Cc1ccc(cc1)-c1nnn[nH]1)Cc1ccccn1)c1ccc(cc1)C#N
CCOc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1nnn[nH]1)Cc1ccccn1
COc1ccc(CN(Cc2ccc(cc2)-c2nnn[nH]2)S(=O)(=O)c2ccc(Cl)cc2)cc1
COc1cccc(CN(Cc2ccc(cc2)-c2nnn[nH]2)S(=O)(=O)c2ccc(Cl)cc2)c1
Fc1ccc(CN(Cc2ccc(cc2)-c2nnn[nH]2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Clc1ccc(cc1)S(=O)(=O)N(CCc1cc2ccccc2cn1)Cc1ccc(cc1)-c1nnn[nH]1
CC(C)(C)c1nc(CCN(Cc2ccc(cc2)-c2nnn[nH]2)S(=O)(=O)c2ccc(Cl)cc2)no1
Fc1cc(CN(Cc2ccccn2)S(=O)(=O)c2ccc(Cl)cc2)ccc1-c1nnn[nH]1
COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(-c2nnn[nH]2)c(F)c1)Cc1ccccn1
Fc1ccccc1CN(Cc1ccc(-c2nnn[nH]2)c(F)c1)S(=O)(=O)c1ccc(cc1)C#N
Fc1ccccc1CN(Cc1ccc(-c2nnn[nH]2)c(F)c1)S(=O)(=O)c1ccc(Cl)cc1
Fc1ccccc1CN(Cc1ccc(cc1)-c1nnn[nH]1)S(=O)(=O)c1ccc(cc1)C#N
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1cccc(Cl)c1)Cc1ccccn1
Fc1cccc(c1)-c1ccc(CN(Cc2ccccn2)S(=O)(=O)c2ccc(Cl)cc2)cc1
Clc1ccc(cc1)S(=O)(=O)N(Cc1ccc(Cc2ccccc2)cc1)Cc1ccccn1
[O-][N+](=O)c1cccc(Cc2ccc(CN(Cc3ccccn3)S(=O)(=O)c3ccc(Cl)cc3)cc2)c1
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3Cl)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(F)cc3Cl)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(CC2)C(C)c2ccc(Cl)cc2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(CC2)C2CCc3cc(Cl)ccc23)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(CC2)C(=O)c2ccc(Cl)cc2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(CC(=O)c3ccc(F)cc3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(CC2)C(=O)c2ccnc3cc(Cl)ccc23)c(Cl)c1 |r|
Fc1ccc(CNC(=O)c2cnc(N3CCN(CC3)C3CCN(Cc4ccc(Cl)cc4)CC3)c(Cl)c2)cc1F
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)NCc1ccc(F)c(F)c1 |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1 |r|
C[C@H]1CN(CCN1c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1)C1CCN(Cc2ccc(Cl)cc2)CC1 |r|
C[C@@H]1CN(CCN1c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1)C1CCN(Cc2ccc(Cl)cc2)CC1 |r|
CC1CN(CCN1c1ccc(cn1)C(=O)NCc1ccc(F)c(F)c1)C1CCN(Cc2ccc(Cl)cc2)CC1
CNC(=O)c1cnc(N2CCN(CC2)C2CCN(Cc3ccc(Cl)cc3)CC2C)c(Cl)c1
CC1(CCN(Cc2ccc(Cl)cc2)CC1)N1CCN(CC1)c1ncc(cc1Cl)C(=O)NCc1ccc(Cl)c(Cl)c1
Fc1ccc(CNC(=O)c2cnc(N3CCN(C4CCN(Cc5ccc(Cl)cc5)CC4)C(=O)C3)c(Cl)c2)cc1F
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3)C(=O)C2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCC(CC2)N2CCN(Cc3ccc(Cl)cc3)C[C@@H]2C)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCC(CC2)N2CCN(Cc3ccc(Cl)cc3)C[C@H]2C)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCC(C(C)C2)N2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(C)=O |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(N)=N |r|
CCNC(=N)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1 |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(NC(C)=O)cc1Cl |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(NC(=O)C2CC2)cc1Cl |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(N)=O |r|
CCNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1 |r|
CC(C)NC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1 |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)NCC1CCCCC1 |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)Nc1ccc(F)c(F)c1 |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)N1CCCCC1 |r|
C[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)N1CCC1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)NC |r|
CNC(=O)c1cnc(N2CCN([C@@H](CC(C)C)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN(C3CCN(Cc4ccc(Cl)cc4)CC3)[C@H](C2)c2ccccc2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN(C3CCN(Cc4ccc(Cl)cc4)CC3)C(C2)C(=O)OC)c(Cl)c1
CNC(=O)c1cnc(N2CCN(C(CO)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1
CNC(=O)c1cnc(N2CCN(C(COC)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1
CNC(=O)c1cnc(N2CCN(C3CCN(Cc4ccc(Cl)cc4)CC3)C(C2)C(O)=O)c(Cl)c1
CNOC(=O)C1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1ncc(cc1Cl)C(=O)NC
CCNC(=O)c1cnc(N2CCN([C@@H](CC)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1 |r|
CCNC(=O)c1cnc(N2CCN([C@@H](CC)C2)C2CCN(Cc3ccc(Cl)cc3F)CC2)c(Cl)c1 |r|
CCNC(=O)c1cnc(N2CCN(C3CCN(Cc4ccc(Cl)cc4)CC3)[C@H](C2)C(C)C)c(Cl)c1 |r|
CCNC(=O)c1cnc(N2CCN(C3CCN(Cc4ccc(Cl)cc4F)CC3)C(C2)C2CC2)c(Cl)c1
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccco3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3cccs3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc[nH]3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccccn3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(cc3)S(C)(=O)=O)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(C)cc3)CC2)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(CC2)C(F)(F)F)c(Cl)c1 |r|
CNC(=O)c1cnc(N2CCN([C@@H](C)C2)C2CCN(Cc3ccc(Cl)cc3F)CC2)c(Cl)c1 |r|
NC(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:17|
CCNC(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:19|
CN(C)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:19|
COCCN(CCOC)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:25|
CN(CCO)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:21|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCC1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCCCC1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CC=CC1 |r,c:13,34|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC=C1 |r,c:13,36|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCNCC1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCNC(=O)C1 |r,c:13|
CN1CCN(CC1)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:24|
CC(=O)N1CCN(CC1)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:26|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCOCC1 |r,c:13|
CC1CN(CC(C)O1)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:25|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCS(=O)(=O)CC1 |r,c:13|
OC1CCN(CC1)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:24|
O[C@@H]1CCN(C[C@@H]1O)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:25|
O[C@H]1CCN(C1)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:23|
Fc1ccccc1NC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:14|
Fc1cccc(NC(=O)N2C[C@@H](C=C3[C@H]2Cc2c[nH]c4cccc3c24)C(=O)N2CCCC2)c1 |r,c:12|
Fc1ccc(NC(=O)N2C[C@@H](C=C3[C@H]2Cc2c[nH]c4cccc3c24)C(=O)N2CCCC2)cc1 |r,c:11|
COc1ccccc1NC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:15|
COc1ccc(NC(=O)N2C[C@@H](C=C3[C@H]2Cc2c[nH]c4cccc3c24)C(=O)N2CCCC2)cc1 |r,c:12|
O=C(Nc1ccsc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:12|
O=C(Nc1cccs1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:12|
O=C(Nc1cc[nH]c1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:12|
O=C(NC1CCCCC1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
O=C(NC1CCCCCC1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:14|
OC1CCC(CC1)NC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,wU:12.30,wD:15.16,c:14,(40.36,-4.55,;39.03,-3.78,;37.69,-4.54,;36.36,-3.77,;36.37,-2.22,;37.7,-1.46,;39.03,-2.24,;35.04,-1.45,;33.71,-2.22,;33.71,-3.76,;32.38,-1.45,;32.39,.1,;31.05,.88,;29.7,.1,;29.71,-1.44,;31.05,-2.22,;31.05,-3.76,;29.72,-4.54,;29.06,-6,;27.52,-6.01,;27.05,-4.54,;25.72,-3.77,;25.73,-2.23,;27.04,-1.47,;28.37,-2.23,;28.38,-3.77,;31.05,2.41,;29.72,3.18,;32.38,3.18,;33.78,2.55,;34.8,3.69,;34.03,5.02,;32.54,4.7,)|
CNC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:7|
O=C(NCc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:14|
O=C(NCc1ccco1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
O=C([C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)c1ccccc1)N1CCCC1 |r,c:16|
O=C(Cc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
CC(C)OC(=O)Cn1cc2C[C@H]3N(C[C@@H](C=C3c3cccc1c23)C(=O)N1CCCC1)C(=O)Nc1ccccc1 |r,c:15|
OCCn1cc2C[C@H]3N(C[C@@H](C=C3c3cccc1c23)C(=O)N1CCCC1)C(=O)Nc1ccccc1 |r,c:11|
CN(C)CCn1cc2C[C@H]3N(C[C@@H](C=C3c3cccc1c23)C(=O)N1CCCC1)C(=O)Nc1ccccc1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1cn(CCN3CCCC3)c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1cn(CCN3CCCCC3)c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
CN1CCN(CCn2cc3C[C@H]4N(C[C@@H](C=C4c4cccc2c34)C(=O)N2CCCC2)C(=O)Nc2ccccc2)CC1 |r,c:15|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1cn(CCN3CCOCC3)c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:13|
O=C(Nc1ccccc1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCCC1 |r,c:13|
O[C@@H]1CCN(C1)C(=O)[C@H]1CN([C@@H]2Cc3c[nH]c4cccc(C2=C1)c34)C(=O)Nc1ccccc1 |r,c:23|
COc1cccc(NC(=O)N2C[C@@H](C=C3[C@H]2Cc2c[nH]c4cccc3c24)C(=O)N2CCCC2)c1 |r,c:13|
CN(C)Cc1ccccc1NC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:17|
CN(C)Cc1ccc(NC(=O)N2C[C@@H](C=C3[C@H]2Cc2c[nH]c4cccc3c24)C(=O)N2CCCC2)cc1 |r,c:14|
O=C(NC1CCCC1)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:12|
CN(C)CCCNC(=O)N1C[C@@H](C=C2[C@H]1Cc1c[nH]c3cccc2c13)C(=O)N1CCCC1 |r,c:12|
CN(C)Cc1cccc(NC(=O)N2C[C@@H](C=C3[C@H]2Cc2c[nH]c4cccc3c24)C(=O)N2CCCC2)c1 |r,c:15|
CC[C@H]1CN([C@H](CC)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(N)=O |r|
CC[C@H]1CN([C@@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(N)=O |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(=O)NC |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(=O)NC1CC1 |r|
CC[C@H]1CN(CCN1C2CCN(CC2)Cc3ccc(cc3)Cl)c4c(nc(c(n4)N)C(=O)N)Cl
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1)c1nc(N)c(nc1Cl)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(cc2)C#N)CC1)c1nc(N)c(nc1Cl)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(CO)c1ccc(Cl)cc1)c1nc(N)c(nc1Cl)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1nc(N)c(nc1Cl)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NC |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCC(F)(F)F |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCCO |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCC(C)O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCC(C)(C)O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCCNS(=O)(=O)C(F)(F)F |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCCNS(N)(=O)=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCCS(C)(=O)=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)N[C@@H]1CCOC1=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(F)c(F)c2)CC1)c1nc(N)c(nc1Cl)C(=O)NCCNS(N)(=O)=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)C(=O)NCCNS(C)(=O)=O |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2[C@H](O)C(N)=O)CC1)c1nc(N)c(nc1Cl)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)C(=O)NCCO |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1Cl)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1Cl)C(=O)NC(C)(C)C |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1Cl)C(=O)NC1CC1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1Cl)C(=O)NC(C)C |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1Cl)C(=O)NCCO |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1Cl)C(=O)NC[C@@H](C)O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C(F)(F)F)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C(F)(F)F)C(=O)NC |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C(F)(F)F)C(=O)NC1CC1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C)C(=O)NC |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C)C(=O)NC1CC1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(N)=O |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(=O)NC |r|
CCNC(=O)c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)cc2)c(C)n1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(=O)NC1CC1 |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)C(N)=O |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(F)cc1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(OC(F)(F)F)cc1)c1nc2ccccn2c(=O)c1-c1ccc(cc1)C#N |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(cc1)C#N |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(cc1)C#N |r|
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)cc1)c1nc2ncccc2c(=O)n1-c1ccc(O)cc1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(F)cc1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(F)cc1 |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(F)cc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(Cl)cc1 |r|
C[C@@H](N(CC1CCS(=O)(=O)CC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(Cl)cc1 |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(Cl)cc1)C(=O)Cc1ccc(c(F)c1)C(F)(F)F |r|
CCS(=O)(=O)CCN([C@H](C)c1nc2ncccc2c(=O)n1-c1ccc(Cl)cc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F |r|
C[C@@H](N(CCS(C)(=O)=O)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)c1nc2ncccc2c(=O)n1-c1ccc(cc1)C#N |r|
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(C)cc1
C[C@@H](N(CCN(C)C)C(=O)Cc1ccc(C)cc1)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(CCN(C)C)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(Cc1ccccn1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCOCCN([C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)Cc1ccc(cc1)C(F)(F)F
CCCCCCCCCCS(=O)(=O)N(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(cc1)C#N
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(Cl)cc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCCCCN(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCC(=O)N(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCN([C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)Cc1ccc(cc1)C(F)(F)F
C[C@@H](N(Cc1nccs1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCOCCN([C@H](CC)c1nc2ccccc2c(=O)n1-c1ccc(OCC)cc1)C(=O)Cc1ccc(cc1)-c1ccccc1
CCOCCN(C(=O)Cc1ccc(cc1)-c1ccccc1)C(C)(C)c1nc2ccccc2c(=O)n1-c1ccc(OCC)cc1
CCOCCN([C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(OCC)cc1)C(=O)Cc1ccc(cc1)-c1ccccc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(cc1)S(C)(=O)=O
CCOCCN(Cc1nc2ccccc2c(=O)n1-c1ccc(OCC)cc1)C(=O)Cc1ccc(cc1)-c1ccccc1
CCCCCCCCCN(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccccc1
CCOc1ccc(cc1)-n1c(nc2cccnc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)cc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(cc1)[N+]([O-])=O
C[C@@H](N(CCN(C)C)C(=O)c1ccc(cc1)-c1ccccc1)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCCCCCC(=O)N(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(NC(C)=O)cc1
COc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F
C[C@@H](N(CC(=O)c1cn(C)cn1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(CC(=O)c1ncc[nH]1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCOCCN([C@H](c1ccccc1)c1nc2ccccc2c(=O)n1-c1ccc(OCC)cc1)C(=O)Cc1ccc(cc1)-c1ccccc1
C[C@@H](N(CCN(C)C)C(=O)Cc1ccc(OC(F)(F)F)cc1)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCCCCCCCC(=O)N(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCOc1ccc(cc1)-n1c(nc2nccnc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)cc1
CC#Cc1ccc(cc1)-n1c(nc2ccccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F
CCCCCCCCS(=O)(=O)N(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCOc1ccc(cc1)-n1c(nc2cnccc2c1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)cc1
C[C@@H](N(CC(=O)c1cnc[nH]1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCCCC(=O)N(CCN(C)C)[C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
COCCN([C@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)Cc1ccc(cc1)C(F)(F)F
C[C@@H](N(CCN(C)C)C(=O)Cc1ccccc1)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
CCCCCCCCCC(=O)N(CCN(C)C)[C@@H](C)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(CCN(C)C)C(=O)Cc1ccc(cc1)-c1ccccc1)c1nc2ccccc2c(=O)n1-c1ccc(F)cc1
C[C@@H](N(Cc1cccnc1)C(=O)Cc1ccc(cc1)C(F)(F)F)c1nc2ccccc2c(=O)n1-c1ccc(cc1)C(O)=O
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(Cl)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(CF)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(C=C)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(cn1-c1ccc(cc1)C#N)-c1ccccn1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1nnc(n1)C1CC1)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1nnc(n1)-c1ccccc1)-c1ccccc1
CCOc1ccc(cc1)-n1ccnc1[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1cnc(c1)-c1ccccc1)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cc1ccc(OC(F)(F)F)cc1)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCCS(=O)(=O)CC)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOCCN([C@H](C)c1nc(cn1-c1ccc(OCC)cc1)-c1ccccc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(C[C@@H]1CCCN1C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(C[C@H]1CCCN1C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(C[C@@H]1CCCN1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(C[C@H]1CCCN1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(Cc1ccccn1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(Cc1ccncc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F)-c1ccccc1
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(-c2ccccc2)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(C#N)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(n1-c1ccc(cc1)C#N)C(F)(F)F)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(C(F)F)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(C2CC2)c(CO)n1-c1ccc(cc1)C#N)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCc1c(nc([C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cc2ccc(F)c(c2)C(F)(F)F)n1-c1ccc(cc1)C#N)C1CC1
CCS(=O)(=O)CCN([C@H](C)c1nc(cn1-c1ccc(cc1)C#N)C(C)(C)C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(cn1-c1ccc(cc1)C#N)C(C)C)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(cn1-c1ccc(cc1)C#N)C1CC1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCS(=O)(=O)CCN([C@H](C)c1nc(cn1-c1ccc(cc1)C#N)-c1cccnc1)C(=O)Cc1ccc(F)c(c1)C(F)(F)F
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1ccc(n1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1nnc(n1)-c1ccc(cc1)C(F)(F)F)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1nnc(n1)-c1ccc(F)cc1)-c1ccccc1
CCOc1ccc(cc1)-n1cc(nc1[C@@H](C)N(CCS(=O)(=O)CC)C(=O)Cn1cc(nn1)-c1ccccc1)-c1ccccc1
CC(=O)c1nc2ccccc2n1CC(=O)c1ccc(cc1)[N+]([O-])=O
Cn1c2c(cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(F)(F)F
Cn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12
Cc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12
Cc1ccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c2c1
Cn1c2ccccc2n(CC(O)c2ccc(Br)cc2)c1=N |w:10.11|
Cn1c2ccccc2n(CCCC(=O)c2ccc(Br)cc2)c1=N
Cn1c2ccccc2n(CS(=O)c2ccc(Cl)cc2)c1=N
Cn1c2ccccc2n(CC(=O)c2ccccc2Cl)c1=N
Cn1c2ccccc2n(CC(=O)c2cccc(Cl)c2)c1=N
Cn1c2ccccc2n(CC(=O)c2ccc(Br)cc2)c1=N
Cn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
CN=c1n(C)c2ccccc2n1CC(=O)c1ccc(Cl)cc1 |w:1.0|
CC(=O)N=c1n(C)c2ccccc2n1CC(=O)c1ccc(cc1)[N+]([O-])=O |w:3.2|
CC(O)c1nc2ccccc2n1CC(=O)c1ccc(cc1)[N+]([O-])=O
CC(=O)c1nc2ccc(cc2n1CC(=O)c1ccc(Br)cc1)-c1ccccc1
CC(=O)c1nc2cc(ccc2n1CC(=O)c1ccc(Br)cc1)-c1ccccc1
COc1ccc2nc(C(C)=O)n(CC(=O)c3ccc(Br)cc3)c2c1
COc1cccc2n(CC(=O)c3ccc(Br)cc3)c(nc12)C(C)=O
CC(=O)c1nc2ccccc2n1CC(=O)c1ccccc1
CC(=O)c1nc2ccccc2n1CC(=O)c1ccc(Br)cc1
CC(=O)c1nc2ccccc2n1CC(=O)c1ccc(cc1)C#N
COc1cccc2n(CC(=O)c3ccc(Br)cc3)c(=N)n(C)c12
CCCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12
Cc1ccc2n(C)c(=N)n(CC(=O)c3ccc(Cl)cc3)c2c1
Cn1c2ccccc2n(CCc2ccc(Br)cc2)c1=N
Cn1c2ccccc2n(CC(=O)c2ccc(Cl)c(Cl)c2)c1=N
COCCN=c1n(C)c2ccccc2n1CC(=O)c1ccc(Br)cc1 |w:4.3|
CS(=O)c1nc2ccccc2n1CC(=O)c1ccc(cc1)[N+]([O-])=O
COc1ccc2n(CC(=O)c3ccc(Br)cc3)c(nc2c1)C(C)=O
CC(=O)c1nc2ccccc2n1CC(=O)c1ccc(Cl)cc1
CC(=O)N1C2CCCC1C=C(CN1[C@H]3CC[C@@H]1C[C@H](C3)Nc1ccc3ccc(cc3n1)C(F)(F)F)C2 |w:4.40,8.9,t:10,TLB:1:3:10.35.9:7.5.6,THB:11:12:19.18.17:14.15|
CC(C)Oc1cc(F)c2ccc(NC3CCN(CC4=CC5CCCC(C4)N5C(C)=O)CC3)nc2c1 |w:24.24,20.19,t:18,TLB:27:26:18.25.19:21.23.22|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3cc(ccc3n1)C(F)(F)F)C2 |w:4.37,8.9,t:10,TLB:1:3:10.33.9:7.5.6|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3cccc(Cl)c3n1)C2 |w:4.34,8.9,t:10,TLB:1:3:10.30.9:7.5.6|
CN(C1CCN(CC2=CC3CCCC(C2)N3C(C)=O)CC1)c1nc2ccccc2s1 |w:13.13,9.8,t:7,TLB:16:15:7.14.8:10.12.11|
CC(C)Oc1cc(F)c2ccc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3=CC4CCCC(C3)N4C(C)=O)nc2c1 |w:28.30,24.25,t:24,TLB:31:30:22.29.23:25.27.26,THB:21:20:14.13.19:16.17|
CC(C)Oc1ccc2ccc(N[C@H]3C[C@@H]4CC[C@H](C3)N4CC3=CC4CCCC(C3)N4C(C)=O)nc2c1 |w:27.29,23.24,t:23,TLB:30:29:21.28.22:24.26.25,THB:20:19:13.12.18:15.16|
CC(=O)N1C2CCCC1C=C(CN1[C@H]3CC[C@@H]1C[C@H](C3)Nc1ccc3cc(ccc3n1)C(F)(F)F)C2 |w:4.40,8.9,t:10,TLB:1:3:10.35.9:7.5.6,THB:11:12:19.18.17:14.15|
CC(=O)N1C2CCCC1C=C(CN1[C@H]3CC[C@@H]1C[C@H](C3)Nc1ccc3cc(OC(F)(F)F)ccc3n1)C2 |w:4.41,8.9,t:10,TLB:1:3:10.36.9:7.5.6,THB:11:12:19.18.17:14.15|
COc1cc(F)c2ccc(NC3CCN(CC4=CC5CCCC(C4)N5C(C)=O)CC3)nc2c1 |w:22.22,18.17,t:16,TLB:25:24:16.23.17:19.21.20|
CC(C)Oc1ccc2ccc(NC3CCN(CC4=CC5CCCC(C4)N5C(C)=O)CC3)nc2c1 |w:23.23,19.18,t:17,TLB:26:25:17.24.18:20.22.21|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3ccc(cc3n1)C(F)(F)F)C2 |w:4.37,8.9,t:10,TLB:1:3:10.33.9:7.5.6|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3cc(OC(F)(F)F)ccc3n1)C2 |w:4.38,8.9,t:10,TLB:1:3:10.34.9:7.5.6|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3cc(Cl)ccc3n1)C2 |w:4.34,8.9,t:10,TLB:1:3:10.30.9:7.5.6|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1cnc3ccccc3n1)C2 |w:4.33,8.9,t:10,TLB:1:3:10.29.9:7.5.6|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3c(cc(nc3n1)C(F)(F)F)C(F)(F)F)C2 |w:4.41,8.9,t:10,TLB:1:3:10.37.9:7.5.6|
CC(=O)N1C2CCCC1C=C(CN1CCC(CC1)Nc1ccc3ccccc3n1)C2 |w:4.33,8.9,t:10,TLB:1:3:10.29.9:7.5.6|
CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccc1
CN(CCCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
CN(Cc1ccccc1)C(=O)CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
CCCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccn1
CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)C(C)(C)C
Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CCCN(C2CC2)C(=O)c2cccc3cccnc23)c1=N
Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(CC[C@@H]2CCCN2C(=O)c2cccc3cccnc23)c1=N
Clc1ccc(cc1)C(=O)Cn1c2cccc(Cl)c2n(C[C@@H]2CCCN(C2)C(=O)c2cccc3cccnc23)c1=N
CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1cccc2cccnc12
COc1ccccc1C(=O)N(C)CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccc2ccccc2c1
CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(CCCN(C)C(=O)Cc3ccccc3)c12
CN(CCCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
CN(CCn1c2c(Cl)cccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)Cc1ccccc1
CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)c1ccccc1
CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(=O)C1CCCCC1
CN(CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N)C(C)=O
CN(Cc1ccccc1)C(=O)Cn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
CCOC(=O)CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
CCn1c2ccccc2n(CC(=O)c2ccc(Cl)cc2)c1=N
c1ccc(cc1)C(CNC(=O)[C@H](CCCCN)NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)CCC(=O)c4ccccc4)c5ccccc5
CC1(C)[C@H]2C[C@@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1I)=CC2 |r,c:27|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1I)=CC2 |r,c:27|
CC1([C@H]2CC=C([C@@H]1C2)C[N+](C)(C)Cc3ccc(cc3)c4ccccc4Br)C
CC1(C)[C@@H]2C[C@H]1[C@H](C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1I)CC2 |r|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1Cl)=CC2 |r,c:27|
COc1ccccc1-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:18|
Cc1ccccc1-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:17|
CC1(C)[C@@H]2C[C@H]1C=C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1I)C2 |r,t:7|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(Br)c1)=CC2 |r,c:27|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(c(Cl)c1)-c1ccccc1Cl)=CC2 |r,c:28|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(Cl)cc1)=CC2 |r,c:20|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cc(Cl)ccc1Cl)=CC2 |r,c:28|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(Cl)c1)=CC2 |r,c:27|
CC1(C)[C@H]2C[C@@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(Cl)c1)=CC2 |r,c:27|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1c(Cl)cccc1Cl)=CC2 |r,c:28|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(Cl)c1Cl)=CC2 |r,c:28|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc-3c(Cc4ccccc-34)c1)=CC2 |r,c:28|
CC1(C)[C@@H]2C[C@H]1C=C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(Cl)c1)C2 |r,t:7|
CC1(C)[C@@H]2C[C@H]1[C@H](C[N+](C)(C)Cc1ccc(cc1)-c1cccc(Cl)c1)CC2 |r|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(c(Cl)c1)-c1cccc(Cl)c1)=CC2 |r,c:28|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1F)=CC2 |r,c:27|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(c(Cl)c1)-c1ccccc1)=CC2 |r,c:27|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1)=CC2 |r,c:26|
Cc1cccc(C)c1-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:18|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccccc1O)=CC2 |r,c:27|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccccc1)=CC2 |r,c:19|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccsc1)=CC2 |r,c:25,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(I)cc1)=CC2 |r,c:20,THB:7:6:4:1|
NC(Nc1ccc(I)cc1)=NC1C2CC3CC(C2)CC1C3 |w:10.11,TLB:20:19:17:14.13.15,THB:20:14:17:11.19.18,15:14:11:16.17.18,15:16:11:14.13.20,TEB:10:11:14.13.20:16.17.18,10:11:13:16.17.15,10:11:17:14.13.15,(2.06,.41,;2.43,-1.08,;1.31,-2.15,;-.17,-1.71,;-1.28,-2.78,;-2.76,-2.34,;-3.12,-.85,;-4.6,-.41,;-2.01,.22,;-.53,-.22,;3.9,-1.52,;5.02,-.45,;6.39,.24,;6.39,1.64,;7.23,3.12,;8.6,2.42,;8.6,1.02,;7.76,-.45,;7.23,.32,;5.86,1.02,;5.86,2.42,)|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccoc1)=CC2 |r,c:25,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cc(Cl)cc(Cl)c1)=CC2 |r,c:28,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccc(Cl)cc1)=CC2 |r,c:27,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(N)c1)=CC2 |r,c:27,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(O)c1)=CC2 |r,c:27,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(c1)[N+]([O-])=O)=CC2 |r,c:29,THB:7:6:4:1|
Cc1cccc(c1)-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:17,TLB:15:16:20:22|
COc1ccc(cc1OC)-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:20,TLB:18:19:23:25|
CC(=O)c1cccc(c1)-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:19,TLB:17:18:22:24|
COC(=O)c1cccc(c1)-c1ccc(C[N+](C)(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:20,TLB:18:19:23:25|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1ccc(cc1)C(F)(F)F)=CC2 |r,c:30,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(c1)C(F)(F)F)=CC2 |r,c:30,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(cc1)-c1cccc(F)c1)=CC2 |r,c:27,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc3oc4ccccc4c3c1)=CC2 |r,c:28,THB:7:6:4:1|
Cn1c2ccccc2c2ccc(C[N+](C)(C)CC3=CC[C@H]4C[C@@H]3C4(C)C)cc12 |r,t:18,TLB:16:17:21:23|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(Oc3ccccc3)cc1)=CC2 |r,c:27,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1cccc(c1)-c1ccccc1)=CC2 |r,c:26,THB:7:6:4:1|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1ccsc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1ccoc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cc(Cl)cc(Cl)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1ccc(Cl)cc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(Cl)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(N)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(O)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(c1)[N+]([O-])=O |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(C)c1 |r,t:3,TLB:2:3:7:9|
COc1ccc(cc1OC)-c1ccc(CN(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:19,TLB:17:18:22:24|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(c1)C(C)=O |r,t:3,TLB:2:3:7:9|
COC(=O)c1cccc(c1)-c1ccc(CN(C)CC2=CC[C@H]3C[C@@H]2C3(C)C)cc1 |r,t:19,TLB:17:18:22:24|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1ccc(cc1)C(F)(F)F |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(c1)C(F)(F)F |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1ccccc1F |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1cccc(F)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc2oc3ccccc3c2c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc2c(c1)n(C)c1ccccc21 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc-2c(Cc3ccccc-23)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(Oc2ccccc2)cc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1cccc(c1)-c1ccccc1 |r,t:3,TLB:2:3:7:9|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)CCc1ccc(Cl)cc1)=CC2 |r,c:21,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(Cl)c(Cl)c1)=CC2 |r,c:21,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(Br)cc1)=CC2 |r,c:20,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccc(F)cc1)=CC2 |r,c:20,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+]1(C)CCc3ccccc3C1)=CC2 |r,c:21,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1ccccc1I)=CC2 |r,c:20,THB:7:6:4:1|
CC1(C)[C@@H]2C[C@H]1C(C[N+](C)(C)Cc1cccc(I)c1)=CC2 |r,c:20,THB:7:6:4:1|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(cc1)-c1ccccc1 |r,t:3,TLB:2:3:7:9|
CN(CCc1ccc(Cl)cc1)CC1=CC[C@H]2C[C@@H]1C2(C)C |r,t:13,TLB:11:12:16:18|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(Cl)c(Cl)c1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(Br)cc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(Cl)cc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(F)cc1 |r,t:3,TLB:2:3:7:9|
CC1(C)[C@@H]2C[C@H]1C(CN1CCc3ccccc3C1)=CC2 |r,c:20,THB:7:6:4:1|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccccc1 |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccccc1I |r,t:3,TLB:2:3:7:9|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1cccc(I)c1 |r,t:3,TLB:2:3:7:9|
CC[N+](C)(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(I)cc1 |r,t:5,TLB:4:5:9:11|
CC1(C)[C@@H]2CC[C@@]1(C)C(C[N+](C)(C)Cc1ccc(I)cc1)C2 |r,THB:9:8:5.4:1|
C[N+](C)(Cc1ccc(I)cc1)C\C1=C\CCCCCC1 |t:13|
C[N+](C)(CCC12CC3CC(CC(C3)C1)C2)Cc1ccc(I)cc1 |TLB:4:5:8.7.12:10,THB:4:5:8:12.11.10,13:5:8:12.11.10,13:11:8:14.6.5,6:7:10:14.5.13,6:5:8.7.12:10|
C[N+](C)(Cc1ccc(I)cc1)CC12CC3CC(CC(C3)C1)C2 |TLB:11:12:15.14.19:17,THB:13:14:17:21.12.20,13:12:15.14.19:17,20:12:15:19.18.17,20:18:15:21.13.12|
C[N+](C)(CC1C2CC3CC(C2)CC1C3)Cc1ccc(I)cc1 |TLB:10:9:13:6.5.4,10:5:8.9.11:13,THB:4:5:8:11.12.13,4:12:8:6.10.5,3:4:8.9.11:13,(9.05,-42.84,;9.84,-41.52,;10.6,-42.84,;8.5,-40.76,;7.17,-41.54,;7.16,-43.07,;5.76,-43.42,;4.43,-42.93,;3.23,-44.21,;4.74,-43.79,;6.14,-44.35,;4.73,-42.2,;5.77,-40.97,;4.42,-41.44,;11.17,-40.73,;12.51,-41.49,;12.51,-43.03,;13.85,-43.79,;15.18,-43.01,;16.53,-43.76,;15.16,-41.46,;13.82,-40.7,)|
CCN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(I)cc1 |r,t:4,TLB:3:4:8:10|
CN(CC1=CC[C@H]2C[C@@H]1C2(C)C)Cc1ccc(I)cc1 |r,t:3,TLB:2:3:7:9|
CN(CC1C[C@H]2CC[C@]1(C)C2(C)C)Cc1ccc(I)cc1 |r,TLB:2:3:7.6:10|
CN(Cc1ccc(I)cc1)C\C1=C\CCCCCC1 |t:12|
CN(CCC12CC3CC(CC(C3)C1)C2)Cc1ccc(I)cc1 |TLB:3:4:7.6.11:9,THB:12:4:7:11.10.9,12:10:7:13.5.4,3:4:7:11.10.9,5:6:9:13.4.12,5:4:7.6.11:9|
CN(CC1C2CC3CC(C2)CC1C3)Cc1ccc(I)cc1 |TLB:9:8:12:5.4.3,9:4:7.8.10:12,THB:3:4:7:10.11.12,3:11:7:5.9.4,2:3:7.8.10:12,(9.33,-21.57,;9.34,-20.04,;8,-19.28,;6.67,-20.06,;6.66,-21.59,;5.26,-21.94,;3.93,-21.45,;2.73,-22.73,;4.24,-22.31,;5.64,-22.87,;4.23,-20.72,;5.27,-19.49,;3.92,-19.96,;10.67,-19.26,;12.01,-20.01,;12.01,-21.55,;13.35,-22.31,;14.68,-21.53,;16.03,-22.28,;14.67,-19.98,;13.33,-19.23,)|
Ic1ccc(CNCC2C3CC4CC(C3)CC2C4)cc1 |TLB:14:13:17:10.9.8,14:9:12.13.15:17,THB:8:9:12:15.16.17,8:16:12:10.14.9,7:8:12.13.15:17,(50.75,-6.19,;49.41,-5.43,;48.08,-6.21,;46.74,-5.45,;46.73,-3.92,;45.39,-3.16,;44.06,-3.94,;42.72,-3.18,;41.39,-3.96,;41.38,-5.49,;39.98,-5.84,;38.65,-5.36,;37.45,-6.63,;38.96,-6.21,;40.36,-6.77,;38.95,-4.62,;39.99,-3.39,;38.64,-3.86,;48.05,-3.13,;49.39,-3.88,)|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2c(F)c(F)c(F)c(F)c2F)CC1 |r,THB:10:8:5.4:1|
Clc1ccc(CN2CCC(CC2)NC23CC4CC(CC(C4)C2)C3)cc1 |TLB:12:13:16:20.19.18,THB:14:15:18:22.13.21,14:13:16.15.20:18,21:13:16:20.19.18,21:19:16:22.14.13|
Fc1cc(Cl)ccc1CN1CCC(CC1)NCC1C2CC3CC(C2)CC1C3 |TLB:23:22:26:19.18.17,23:18:21.22.24:26,THB:16:17:21.22.24:26,17:18:21:24.25.26,17:25:21:19.23.18,(22.53,-11.55,;23.87,-10.79,;25.2,-11.56,;26.54,-10.79,;27.87,-11.56,;26.53,-9.24,;25.2,-8.48,;23.88,-9.25,;22.55,-8.48,;21.21,-9.25,;19.87,-8.47,;18.54,-9.25,;18.54,-10.8,;19.87,-11.57,;21.21,-10.8,;17.2,-11.56,;15.82,-10.88,;14.54,-11.73,;14.52,-13.26,;13.12,-13.6,;11.8,-13.11,;10.6,-14.38,;12.1,-13.97,;13.51,-14.53,;12.1,-12.38,;13.14,-11.15,;11.79,-11.62,)|
Fc1cc(Cl)ccc1CN1CCC(CC1)NCC12CC3CC(CC(C3)C1)C2 |TLB:16:17:20:24.23.22,THB:18:19:22:26.17.25,18:17:20.19.24:22,25:17:20:24.23.22,25:23:20:26.18.17|
CN(C1CCN(Cc2ccc(Cl)cc2F)CC1)C1C2CC3CC(C2)CC1C3 |TLB:23:22:26:19.18.17,23:18:21.22.24:26,THB:17:18:21:24.25.26,17:25:21:19.23.18,1:17:21.22.24:26,(14.59,-25.01,;14.67,-23.47,;16.01,-22.7,;16.01,-21.16,;17.34,-20.38,;18.69,-21.16,;20.02,-20.39,;21.35,-21.16,;22.67,-20.39,;24.01,-21.15,;24.01,-22.7,;25.34,-23.47,;22.67,-23.47,;21.34,-22.7,;20.01,-23.46,;18.69,-22.7,;17.34,-23.47,;13.42,-22.57,;12.01,-23.17,;11.14,-22.02,;11.06,-20.61,;9.42,-20.02,;10.4,-21.23,;10.44,-22.74,;11.85,-20.59,;13.39,-21.06,;12.42,-20.01,)|
CN(CC1C2CC3CC(C2)CC1C3)C1CCN(Cc2ccc(Cl)cc2F)CC1 |TLB:9:8:12:5.4.3,9:4:7.8.10:12,THB:2:3:7.8.10:12,3:4:7:10.11.12,3:11:7:5.9.4,(-2.92,-37.52,;-2.97,-35.98,;-4.34,-35.3,;-5.63,-36.15,;-5.64,-37.67,;-7.04,-38.02,;-8.36,-37.53,;-9.56,-38.8,;-8.06,-38.38,;-6.66,-38.95,;-8.07,-36.8,;-7.03,-35.57,;-8.37,-36.04,;-1.63,-35.21,;-1.63,-33.67,;-.3,-32.89,;1.05,-33.67,;2.38,-32.9,;3.71,-33.67,;5.03,-32.9,;6.37,-33.66,;6.37,-35.21,;7.7,-35.98,;5.03,-35.98,;3.7,-35.21,;2.37,-35.97,;1.05,-35.21,;-.3,-35.98,)|
CC12CC3CC(C)(CC(C1)C3NC1CCN(Cc3ccc(Cl)cc3F)CC1)C2 |TLB:10:3:27:7.8.9,10:8:27:2.4.3,11:10:27.5.7:9,THB:4:5:9:2.3.10,4:3:27.5.7:9,6:5:9:2.3.10,(9.45,-16.98,;10.52,-15.86,;11.59,-14.94,;11.97,-13.55,;12.59,-15.06,;11.41,-16.01,;12.76,-16.75,;10.02,-15.24,;9.46,-13.73,;9.22,-15.14,;10.65,-12.79,;10.61,-11.26,;11.97,-10.5,;11.97,-8.95,;13.3,-8.17,;14.64,-8.95,;15.98,-8.18,;17.31,-8.95,;18.63,-8.18,;19.96,-8.94,;19.97,-10.49,;21.3,-11.26,;18.63,-11.26,;17.3,-10.49,;15.96,-11.25,;14.64,-10.5,;13.3,-11.27,;11.04,-17.52,)|
Fc1cc(Cl)ccc1CN1CCC(CC1)NC1C2CC3CC1CN(C3)C2 |TLB:25:23:20:18.17.16,16:17:24:22.21.20,15:16:24.23.22:20,THB:25:17:24.23.22:20,16:21:24:18.25.17,(1.24,-51.04,;2.57,-50.28,;3.9,-51.05,;5.24,-50.28,;6.57,-51.05,;5.24,-48.73,;3.9,-47.97,;2.58,-48.74,;1.25,-47.97,;-.08,-48.74,;-1.43,-47.96,;-2.76,-48.74,;-2.76,-50.28,;-1.43,-51.05,;-.08,-50.28,;-4.12,-51.03,;-5.35,-50.1,;-6.77,-50.65,;-7.61,-49.48,;-7.65,-48.07,;-6.27,-47.51,;-5.33,-48.58,;-6.86,-48.07,;-8.33,-48.67,;-9.28,-47.43,;-8.33,-50.18,)|
CC(N1CCC(CC1)NC1C2CC3CC(C2)CC1C3)c1ccc(Cl)cc1F |TLB:15:14:18:11.10.9,15:10:13.14.16:18,THB:9:10:13:16.17.18,9:17:13:11.15.10,8:9:13.14.16:18,(21.6,-1.52,;21.59,.02,;20.24,.78,;18.91,-0,;17.58,.75,;17.56,2.3,;18.88,3.09,;20.22,2.33,;16.21,3.05,;14.89,2.26,;14.88,.73,;13.48,.39,;12.15,.87,;10.96,-.4,;12.46,.02,;13.87,-.55,;12.45,1.61,;13.49,2.84,;12.15,2.36,;22.91,.81,;22.89,2.34,;24.21,3.13,;25.56,2.37,;26.89,3.16,;25.58,.83,;24.25,.05,;24.26,-1.5,)|
Fc1cc(Cl)ccc1CN1CCC(CNC2C3CC4CC(C3)CC2C4)CC1 |TLB:21:20:24:17.16.15,21:16:19.20.22:24,THB:15:16:19:22.23.24,15:23:19:17.21.16,14:15:19.20.22:24,(1.3,-11.84,;2.63,-11.06,;3.97,-11.82,;5.3,-11.03,;6.64,-11.79,;5.28,-9.48,;3.94,-8.73,;2.62,-9.52,;1.28,-8.77,;-.05,-9.55,;-.04,-11.09,;-1.36,-11.87,;-2.7,-11.12,;-4.02,-11.91,;-5.37,-11.16,;-6.69,-11.95,;-6.7,-13.47,;-8.1,-13.82,;-9.43,-13.33,;-10.63,-14.61,;-9.13,-14.19,;-7.72,-14.75,;-9.13,-12.6,;-8.09,-11.37,;-9.44,-11.84,;-2.73,-9.58,;-1.4,-8.79,)|
CCOC(=O)C1=C(CCN(Cc2ccc(Cl)cc2F)C1)NC1C2CC3CC(C2)CC1C3 |t:5,TLB:27:26:30:23.22.21,27:22:25.26.28:30,THB:21:22:25:28.29.30,21:29:25:23.27.22,20:21:25.26.28:30,(14.87,-6.27,;16.23,-7,;16.28,-8.53,;17.64,-9.26,;18.95,-8.45,;17.69,-10.8,;16.38,-11.62,;16.42,-13.16,;17.77,-13.88,;19.09,-13.08,;20.44,-13.81,;20.48,-15.35,;21.83,-16.08,;21.88,-17.61,;20.56,-18.42,;20.6,-19.96,;19.2,-17.69,;19.16,-16.15,;17.81,-15.41,;19.04,-11.54,;15.03,-10.89,;13.72,-11.7,;13.73,-13.23,;12.34,-13.6,;11.01,-13.13,;9.83,-14.43,;11.32,-13.98,;12.74,-14.52,;11.29,-12.4,;12.31,-11.15,;10.97,-11.64,)|
CCOC(=O)C1CN(Cc2ccc(Cl)cc2F)CCC1NC1C2CC3CC(C2)CC1C3 |TLB:27:26:30:23.22.21,27:22:25.26.28:30,THB:21:22:25:28.29.30,21:29:25:23.27.22,20:21:25.26.28:30,(30.42,-6.44,;31.78,-7.17,;31.83,-8.71,;33.18,-9.43,;34.49,-8.62,;33.23,-10.97,;34.59,-11.71,;34.63,-13.25,;35.99,-13.99,;36.03,-15.52,;37.37,-16.25,;37.42,-17.78,;36.1,-18.6,;36.15,-20.13,;34.75,-17.86,;34.71,-16.32,;33.36,-15.58,;33.32,-14.06,;31.97,-13.33,;31.93,-11.79,;30.57,-11.06,;29.26,-11.87,;29.28,-13.4,;27.89,-13.77,;26.55,-13.3,;25.38,-14.6,;26.87,-14.15,;28.29,-14.69,;26.84,-12.57,;27.86,-11.32,;26.52,-11.82,)|
Fc1cc(Cl)ccc1CNC1CCN(CC1)C1C2CC3CC(C2)CC1C3 |TLB:22:21:25:18.17.16,22:17:20.21.23:25,THB:16:17:20:23.24.25,16:24:20:18.22.17,13:16:20.21.23:25,(1.61,-27.06,;1.57,-25.52,;2.88,-24.72,;2.84,-23.17,;4.16,-22.36,;1.48,-22.44,;.17,-23.25,;.22,-24.78,;-1.1,-25.58,;-2.45,-24.85,;-3.77,-25.65,;-3.73,-27.19,;-5.03,-28,;-6.39,-27.27,;-6.44,-25.73,;-5.12,-24.92,;-7.7,-28.08,;-7.68,-29.61,;-9.08,-29.98,;-10.41,-29.51,;-11.59,-30.81,;-10.1,-30.37,;-8.68,-30.9,;-10.13,-28.78,;-9.11,-27.53,;-10.45,-28.02,)|
Fc1cc(Cl)ccc1CN1CCCC(C1)NC1C2CC3CC(C2)CC1C3 |TLB:22:21:25:18.17.16,22:17:20.21.23:25,THB:15:16:20.21.23:25,16:17:20:23.24.25,16:24:20:18.22.17,(1.91,-3.49,;1.97,-5.03,;.67,-5.86,;.74,-7.4,;-.56,-8.23,;2.11,-8.11,;3.41,-7.28,;3.33,-5.75,;4.63,-4.92,;4.59,-3.38,;5.91,-2.58,;5.86,-1.04,;4.5,-.3,;3.2,-1.12,;3.24,-2.65,;1.84,-.39,;.53,-1.2,;.47,-2.73,;-.94,-3.03,;-2.24,-2.5,;-3.48,-3.74,;-1.97,-3.37,;-.58,-3.97,;-1.93,-1.78,;-.85,-.58,;-2.21,-1.01,)|
Fc1cc(Cl)ccc1CN1CCCN(CC1)C1C2CC3CC(C2)CC1C3 |TLB:22:21:25:18.17.16,22:17:20.21.23:25,THB:13:16:20.21.23:25,16:17:20:23.24.25,16:24:20:18.22.17,(32.21,-28.7,;33.05,-27.41,;34.59,-27.49,;35.43,-26.19,;36.97,-26.26,;34.72,-24.81,;33.18,-24.74,;32.36,-26.03,;30.81,-25.96,;30.13,-27.34,;30.99,-28.54,;30.59,-30.01,;29.22,-30.66,;27.81,-29.95,;27.51,-28.42,;28.52,-27.26,;26.52,-30.8,;26.55,-32.33,;25.15,-32.71,;23.81,-32.25,;22.64,-33.56,;24.14,-33.1,;25.56,-33.64,;24.09,-31.51,;25.11,-30.26,;23.77,-30.76,)|
Fc1cc(Cl)ccc1NC(=O)N1CCC(CC1)NC1C2CC3CC(C2)CC1C3 |TLB:24:23:27:20.19.18,24:19:22.23.25:27,THB:18:19:22:25.26.27,18:26:22:20.24.19,17:18:22.23.25:27,(2.28,-43.49,;3.6,-42.69,;4.95,-43.42,;6.27,-42.61,;7.62,-43.35,;6.22,-41.07,;4.87,-40.34,;3.57,-41.15,;2.21,-40.41,;.9,-41.22,;.94,-42.76,;-.46,-40.49,;-1.77,-41.29,;-3.12,-40.56,;-3.18,-39.02,;-1.86,-38.21,;-.5,-38.94,;-4.53,-38.3,;-5.84,-39.11,;-5.9,-40.63,;-7.31,-40.94,;-8.62,-40.41,;-9.86,-41.65,;-8.35,-41.27,;-6.96,-41.88,;-8.3,-39.69,;-7.23,-38.49,;-8.59,-38.92,)|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(Cl)cc2F)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccccc2)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccccn2)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2cccnc2)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(F)c(c2)C(F)(F)F)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2cc(F)cc(c2)C(F)(F)F)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(Cl)cc2)CC1 |r,THB:10:8:5.4:1|
COc1ccc(CN2CCC(CC2)N[C@@H]2C[C@H]3CC[C@]2(C)C3(C)C)c(F)c1 |r,TLB:13:14:18.17:21|
COc1ccc(CN2CCC(CC2)N[C@@H]2C[C@H]3CC[C@]2(C)C3(C)C)cc1 |r,TLB:13:14:18.17:21|
COc1ccccc1CN1CCC(CC1)N[C@@H]1C[C@H]2CC[C@]1(C)C2(C)C |r,TLB:15:16:20.19:23|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2cccc(OC(F)(F)F)c2)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(CC(N)=O)cc2)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(N)cc2)CC1 |r,THB:10:8:5.4:1|
CN(C)c1ccc(CN2CCC(CC2)N[C@@H]2C[C@H]3CC[C@]2(C)C3(C)C)cc1 |r,TLB:14:15:19.18:22|
CC1(C)[C@@H]2CC[C@@]1(C)[C@H](C2)NC1CCN(Cc2ccc(Cl)cc2F)CC1 |r,TLB:10:8:4.5:1|
CN([C@H]1C[C@H]2CC[C@]1(C)C2(C)C)C1CCN(Cc2ccc(Cl)cc2F)CC1 |r,TLB:1:2:6.5:9|
CC1(C)C2CC[C@@]1(C)C(CNC1CCN(Cc3ccc(Cl)cc3F)CC1)C2 |r,THB:9:8:5.4:1|
Fc1cc(Cl)ccc1CN1CCC(CC1)NCCC(c1ccccc1)c1ccccc1
Fc1cc(Cl)ccc1CN1CCC(CC1)N1CCc2ccccc2C1
Fc1cc(Cl)ccc1CN1CCC(CC1)N1CCCC1
Fc1cc(Cl)ccc1CN1CCC(CC1)NC\C1=C\CCCCCC1 |t:19|
Fc1cc(Cl)ccc1CN1CCC(CC1)NC1CCCCC1
Fc1cc(Cl)ccc1CN1CCC(CC1)NCC1CCCCC1
CC1(C)C2CC1C(CNC1CCN(Cc3ccc(Cl)cc3F)CC1)=CC2 |c:26,TLB:7:6:1:4|
CN1C2CCC1CC(C2)NC1CCN(Cc2ccc(Cl)cc2F)CC1
Fc1cc(Cl)ccc1CN1CCC(CC1)NC1C2CC3CC(C2)CC1C3 |TLB:22:21:25:18.17.16,22:17:20.21.23:25,THB:16:17:20:23.24.25,16:24:20:18.22.17,15:16:20.21.23:25,(19.96,-46.51,;21.3,-45.74,;22.63,-46.51,;23.97,-45.74,;25.3,-46.51,;23.96,-44.2,;22.63,-43.43,;21.31,-44.2,;19.98,-43.43,;18.64,-44.2,;17.3,-43.42,;15.97,-44.2,;15.97,-45.75,;17.3,-46.52,;18.64,-45.75,;14.63,-46.52,;13.32,-45.7,;11.93,-46.32,;11.03,-45.19,;10.93,-43.78,;9.27,-43.22,;10.27,-44.41,;10.34,-45.93,;11.72,-43.75,;13.27,-44.19,;12.28,-43.16,)|
Clc1ccc(CN2CCC(CC2)NC2C3CC4CC(C3)CC2C4)cc1 |TLB:19:18:22:15.14.13,19:14:17.18.20:22,THB:13:14:17:20.21.22,13:21:17:15.19.14,12:13:17.18.20:22,(5.25,-.44,;3.92,.33,;2.58,-.44,;1.25,.33,;1.26,1.87,;-.07,2.64,;-1.41,1.87,;-2.75,2.65,;-4.08,1.87,;-4.08,.32,;-2.75,-.45,;-1.41,.32,;-5.42,-.43,;-6.65,.5,;-8.09,0,;-8.88,1.21,;-8.86,2.62,;-10.46,3.33,;-9.57,2.05,;-9.63,.54,;-8.07,2.58,;-6.57,2.01,;-7.46,3.12,;2.58,2.64,;3.92,1.88,)|
C(N1CCC(CC1)NC1C2CC3CC(C2)CC1C3)c1ccccc1 |TLB:14:13:17:10.9.8,14:9:12.13.15:17,THB:8:9:12:15.16.17,8:16:12:10.14.9,7:8:12.13.15:17,(21.34,2.39,;20,1.62,;18.66,2.4,;17.33,1.62,;17.33,.07,;18.66,-.7,;20,.07,;15.99,-.7,;14.75,.21,;13.31,-.31,;12.5,.88,;12.5,2.29,;10.88,2.97,;11.8,1.71,;11.76,.19,;13.28,2.27,;14.8,1.72,;13.89,2.81,;22.67,1.61,;22.66,.07,;23.99,-.7,;25.33,.07,;25.32,1.62,;23.99,2.38,)|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccco2)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(F)cc2F)CC1 |r,THB:10:8:5.4:1|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccccc2F)CC1 |r,THB:10:8:5.4:1|
COc1cccc(CN2CCC(CC2)N[C@@H]2C[C@H]3CC[C@]2(C)C3(C)C)c1 |r,TLB:14:15:19.18:22|
COC(=O)c1ccc(CN2CCC(CC2)N[C@@H]2C[C@H]3CC[C@]2(C)C3(C)C)cc1 |r,TLB:15:16:20.19:23|
CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](C2)NC1CCN(Cc2ccc(cc2)N=[N+]=[N-])CC1 |r,THB:10:8:5.4:1|
CN([C@@H]1C[C@H]2CC[C@]1(C)C2(C)C)C1CCN(Cc2ccc(Cl)cc2F)CC1 |r,TLB:1:2:6.5:9|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)-c1nnc[nH]1 |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)-c1ncc[nH]1 |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)-c1nnc(N)o1 |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1ncc(nc1C)-c1nnc(NC)o1 |r|
CCNc1nnc(o1)-c1cnc(N2C[C@H](CC)N(C[C@H]2C)C2CCN(CC2)C(=O)c2ccc(Cl)cc2)c(n1)C(F)(F)F |r|
CCNc1nnc(o1)-c1cnc(N2C[C@H](CC)N(C[C@H]2C)C2CCN(CC2)C(=O)c2ccc(Cl)cc2)c(C)n1 |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)cc2)c(C)n1 |r|
CC[C@H]1CN([C@H](C)CN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1ncc(nc1C)-c1ncc[nH]1 |r|
CCNc1nnc(o1)-c1cnc(N2C[C@H](CC)N(C[C@H]2C)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(n1)C(F)(F)F |r|
CCNc1nnc(o1)-c1cnc(N2C[C@H](CC)N(C[C@H]2C)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(C)n1 |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(n1)C(C)C |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(n1)C1CC1 |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(CC)n1 |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(n1)C(F)(F)F |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(C)n1 |r|
CCNc1nnc(o1)-c1cnc(N2CCN([C@@H](CC)C2)C2CCN(CC2)C(=O)c2ccc(Cl)nc2N)c(Cl)n1 |r|
CCNc1nnc(o1)-c1nc(Cl)c(nc1N)N1CCN([C@@H](CC)C1)C1CCN(CC1)C(=O)c1ccc(Cl)nc1N |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(NC)o1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(NCCO)o1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(o1)N(C)C |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(NS(C)(=O)=O)o1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(N)o1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(CO)o1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(o1)C1CC1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)nc1N)c1nc(N)c(nc1Cl)-c1nnc(C)o1 |r|
CC[C@H]1CN(CCN1C1CCN(CC1)C(=O)c1ccc(Cl)cc1)c1nc(N)c(nc1Cl)-c1nnc(C)o1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)-c1nnc(C)o1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2)CC1)c1nc(N)c(nc1Cl)-c1nnco1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)-c1nnco1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)-c1ncon1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)-c1nc(=O)o[nH]1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)-c1nnn[nH]1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)-c1nnc[nH]1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)C1=NCCN1 |r,t:34|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)-c1ncc[nH]1 |r|
CC[C@H]1CN(CCN1C1CCN(Cc2ccc(Cl)cc2F)CC1)c1ncc(cc1Cl)C#N |r|
CC(C)(C)OC(=O)NCCCC[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
NCCCC[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(=O)CCC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccc(F)cc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCCc1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
COc1ccc(cc1OC)C(=O)CCC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccc(cc1)S(C)(=O)=O)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
COc1ccc(cc1)C(=O)CCC(=O)N1Cc2ccccc2C[C@H]1C(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NCC(c1ccccc1)c1ccccc1
CC(C)(C)OC(=O)NCCCC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCc1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1
N[C@@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1
CC(C)(C)OC(=O)N[C@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1 |r|
N[C@H](CCCCNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)CCC(=O)c1ccccc1)C(=O)NCC(c1ccccc1)c1ccccc1
CC1CCN(CC1)C(=O)C(CCn1cccc1C#N)NS(=O)(=O)c1cc(Cl)c(N)c(Cl)c1
CC1CCN(CC1)C(=O)C(CCn1cccc1C#N)NS(=O)(=O)c1cccc2[nH]ccc12
CCOc1ccc(cc1)N1C(Nc2ncccc2C1=O)[C@@H](C)N(Cc1cccnc1)C(=O)Cc1ccc(OC(F)(F)F)cc1 |r|
CC(N(C)Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)c1ccc2OCCc2c1
COc1cc(CN(CC(C)C)Cc2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CNCc2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2ccc3OCCc3c2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2ccc(\C=C\C(O)=O)cc2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CNC(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
CCCC(NCc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1
COc1cc(CN(CCCC(O)=O)C(C2CCCC2)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
CC(N(C)Cc1ccc(OCCN2C(=O)CCC2=O)c(Cl)c1)c1ccc2OCCc2c1
C[C@H](N(C[C@H]1CC[C@@H](CC1)C(O)=O)Cc1ccc(OCCN2C(=O)CN(C)C2=O)c(C)c1)c1ccc(Cl)cc1 |r,wU:1.0,4.3,wD:7.10,(33.96,-33.61,;33.96,-32.07,;35.32,-31.35,;35.32,-29.8,;36.72,-29.07,;36.72,-27.54,;38.13,-26.81,;39.44,-27.62,;39.44,-29.16,;38.03,-29.89,;40.79,-26.9,;42.1,-27.71,;40.79,-25.36,;36.59,-32.15,;36.59,-33.69,;35.23,-34.42,;35.23,-35.96,;36.5,-36.76,;36.5,-38.3,;37.76,-39.11,;37.76,-40.65,;36.4,-41.52,;36.4,-43.06,;37.61,-44.01,;34.92,-43.5,;34.05,-42.22,;32.51,-42.22,;35,-41,;34.56,-39.52,;37.86,-36.03,;39.17,-36.83,;37.86,-34.49,;32.65,-31.27,;31.29,-31.99,;30.04,-31.19,;30.04,-29.65,;28.73,-28.83,;31.38,-28.92,;32.65,-29.72,)|
COc1cc(CN(C)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(C)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CN(C)C1=O
COc1cc(CN(C)C(C)c2ccc3OCCc3c2)ccc1NCCN1C(=O)CCC1=O
CCC(N(CC)Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1
CCCC(N(C)Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1
COc1cc(CN(C)C(CC(C)C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CNC(C)(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
CCC(NCc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1
COc1cc(CN(CCO)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CCN)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CC2CCCCC2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CCCC(O)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2ccc(cc2)C(O)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2ccc(cc2)-c2nnn[nH]2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(C[C@H]2CC[C@@H](CC2)C(O)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r,wU:8.7,wD:11.14,(32.38,-52.25,;33.71,-51.47,;35.05,-52.22,;36.38,-51.44,;37.72,-52.21,;39.05,-51.43,;39.05,-49.9,;40.37,-49.12,;41.71,-49.88,;43.04,-49.09,;44.39,-49.85,;44.39,-51.39,;43.05,-52.17,;41.71,-51.41,;45.5,-52.46,;45.13,-53.96,;46.97,-52.03,;37.71,-49.14,;36.38,-49.92,;37.71,-47.6,;39.03,-46.83,;39.03,-45.29,;37.68,-44.53,;37.34,-43.02,;35.8,-42.87,;35.18,-44.29,;36.34,-45.32,;36.34,-46.85,;37.72,-53.75,;36.41,-54.53,;35.05,-53.77,;33.74,-54.56,;32.4,-53.8,;31.08,-54.59,;29.82,-53.7,;28.36,-54.19,;27.91,-55.66,;27.44,-52.96,;28.33,-51.7,;29.82,-52.16,;31.04,-51.24,)|
COC(=O)[C@H]1CC[C@H](CN(Cc2ccc(OCCN3C(=O)CCC3=O)c(OC)c2)[C@H]2CCc3cc(Cl)ccc23)CC1 |r,wU:29.30,7.7,wD:4.3,(37.37,-23.54,;35.95,-24.26,;35.95,-25.8,;37.26,-26.62,;34.59,-26.52,;33.29,-25.71,;31.88,-26.43,;31.88,-27.97,;30.47,-28.69,;30.47,-30.23,;31.73,-31.04,;31.73,-32.58,;30.37,-33.31,;30.37,-34.85,;31.64,-35.66,;31.64,-37.2,;32.9,-38.01,;32.9,-39.55,;34.13,-40.41,;35.58,-39.87,;36,-38.39,;36.53,-41.09,;35.67,-42.36,;34.13,-41.94,;32.98,-42.89,;33,-34.92,;34.31,-35.73,;34.31,-37.27,;33,-33.39,;29.12,-30.96,;29.12,-32.51,;27.59,-32.96,;26.71,-31.68,;25.17,-31.46,;24.59,-30.03,;23.07,-29.81,;25.55,-28.81,;27.07,-29.02,;27.65,-30.44,;33.19,-28.78,;34.59,-28.06,)|
COc1cc(CN(C)[C@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CNC(CC(C)C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CC23CCC(CC2)(CC3)C(O)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CC(C)=O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(C)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CSC1=O
COc1cc(CN(Cc2ccc(cc2)C(O)=O)[C@H](C)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(CC(C)C)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2ccncc2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CC(C)O)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2ccc(F)cc2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
CCC(N(Cc1ccc(cc1)C(O)=O)Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1
COc1cc(CN(Cc2ccc(cc2)C(O)=O)C(C2CCCC2)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(C)[C@@H](C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(C)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CNC1=O
CCC(N(CC(C)C)Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)c1ccc2OCCc2c1
COc1cc(CNC(C2CCCC2)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(Cc2cccnc2)C(C)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
Cc1cc(CN(CC2CCCC2)[C@@H](CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)[C@@H](CC(O)=O)c1ccc(Cl)cc1 |r|
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc(Cl)c(Cl)c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(C(CC(O)=O)c2ccc(Cl)cc2)C2CCC2)ccc1OCCn1c(=O)ccn(C)c1=O
CCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
Cc1cc(CN(C(CC(O)=O)c2ccc(Cl)cc2)C2CCC2)ccc1OCCN1C(=O)CCC1=O
C[C@H](N(CC1CCCC1)Cc1ccc(OCCN2C(=O)CCC2=O)c(c1)C(O)=O)c1ccc(Cl)cc1 |r|
OC(=O)C[C@H](N(CC1CC1)Cc1ccc(OCCN2C(=O)CCC2=O)c(F)c1)c1ccc(Cl)c(Cl)c1 |r|
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc3OCCc3c2)ccc1OCCN1C(=O)CCC1=O
CCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc(Cl)c(F)c2)ccc1OCCN1C(=O)CCC1=O
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc3OCCc3c2)ccc1OCCn1c(=O)ccn(C)c1=O
Cc1cc(CN(Cc2ccc(F)cc2)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O
CCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(OC)c1)C(CC(O)=O)c1ccc(Cl)cc1
Cc1cc(CN(C(CC(O)=O)c2ccc(Cl)cc2)C2CCC2)ccc1OCCn1c(=O)ccn(C)c1=O
Cc1cc(CN(CC2CC2)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCn1c(=O)ccn(C)c1=O
CN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
CCCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C1C(Cc2cc(Cl)ccc12)C(O)=O
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)C(C(O)=O)c1ccc(Cl)cc1
COc1cc(CN(CC2CC2)[C@@H](CC(O)=O)c2ccc(Cl)c(F)c2)ccc1OCCN1C(=O)CCC1=O |r|
OC(=O)C[C@H](N(CC1CC1)Cc1ccc(OCCN2C(=O)CCC2=O)c(F)c1)c1ccc(Cl)c(F)c1 |r|
OC(=O)C[C@H](N(CC1CC1)Cc1ccc(OCCN2C(=O)CCC2=O)c(Cl)c1)c1ccc(Cl)c(F)c1 |r|
CCCCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(OC)c1)C(CC(O)=O)c1ccc2OCCc2c1
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)[C@@H](CC(O)=O)c1ccc(Cl)c(F)c1 |r|
Cc1cc(CN(CC2CC2)[C@@H](CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(CC(C)C)[C@H](CC(O)=O)c2ccc(Cl)cc2)ccc1OCCn1c(=O)ccn(C)c1=O |r|
COc1cc(CN(CC(C)C)[C@@H](CC(O)=O)c2ccc(Cl)cc2)ccc1OCCn1c(=O)ccn(C)c1=O |r|
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)c(F)c1
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc2OCCc2c1
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc(Cl)cc2Cl)ccc1OCCN1C(=O)CCC1=O
CCCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(OC)c1)C(CC(O)=O)c1ccc2OCCc2c1
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCn1c(=O)ccn(C)c1=O
CCCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(OC)c1)C(CC(O)=O)c1ccc(Cl)cc1
COc1cc(CN(CC(C)C)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O
Cc1cc(CN(CC2CCCC2)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)[C@H](CC(O)=O)c1ccc(Cl)cc1 |r|
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1Cl
CCCCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(OC)c1)C(CC(O)=O)c1ccc(Cl)cc1
COc1cc(CN(CC2CC2)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCn1c(=O)ccn(C)c1=O
CCCN(Cc1ccc(OCCn2c(=O)ccn(C)c2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)cc1
Cc1cc(CN(CCC(F)(F)F)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O
Cc1cc(CN(CC2CC2)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(c1ccc(Cl)cc1)C1(CC1)C(O)=O
COc1cc(CN(CC2CCCC2)[C@@H](CC(O)=O)c2ccc(Cl)c(F)c2)ccc1OCCN1C(=O)CCC1=O |r|
Cc1cc(CN(CC2CCCC2)[C@@H](CC(O)=O)c2ccc(Cl)c(F)c2)ccc1OCCN1C(=O)CCC1=O
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)[C@@H](CC(O)=O)c1ccc(Cl)cc1 |r|
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(OC)c1)C(C(C)C(O)=O)c1ccc(Cl)cc1
Cc1cc(CN(CC2CCCCC2)C(CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O
CCc1cc(CN(CC2CCCC2)[C@@H](CC(O)=O)c2ccc(Cl)cc2)ccc1OCCN1C(=O)CCC1=O |r|
COc1cc(CN(CC2CC2)C(CC(O)=O)c2ccc3OCCc3c2)ccc1OCCn1c(=O)ccn(C)c1=O
CCCN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)s1
CC(C)CN(Cc1ccc(OCCN2C(=O)CCC2=O)c(C)c1)C(CC(O)=O)c1ccc(Cl)c(Cl)c1