1571 SMILES Strings for RNA-directed RNA polymerase

Compound Name
SMILES String
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1nc(c[nH]1)C1CC1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1nc(c[nH]1)-c1ccccc1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1nc(c[nH]1)C1CCCC1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1ncc[nH]1
Cc1[nH]c(nc1C1CC1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
CCc1[nH]c(nc1C1CC1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Cc1nc([nH]c1C)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Cc1c[nH]c(n1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Cc1ccc(Cn2c3nc(nc(N)c3[nH]c2=O)-c2ncc[nH]2)cn1
Nc1nc(nc2n(CC3CCOCC3)c(=O)[nH]c12)-c1nc(c[nH]1)C1CC1
COCCn1ccnc1-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Cn1ccnc1-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1cncnc1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1ccc[nH]1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1cn[nH]c1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1ccco1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1ccn[nH]1
Nc1nc(nc2n(Cc3ccc4CCNCc4c3)c(=O)[nH]c12)-c1ncc[nH]1
Nc1nc(nc2n(Cc3cccc(CN4CCCC4)c3)c(=O)[nH]c12)-c1ncc[nH]1
Cc1ccc(Cn2c3nc(nc(N)c3[nH]c2=O)-c2nc(c[nH]2)C2CC2)cn1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1nccn1CCO
CC(C)(C)c1c[nH]c(n1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
CC(C)c1c[nH]c(n1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
CCc1c[nH]c(n1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1nc(c[nH]1)C(F)(F)F
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-c1cnco1
Cc1noc(n1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
COCCc1nnc(o1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Cc1cnn(c1)-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
Nc1nc(nc2n(Cc3ccccc3)c(=O)[nH]c12)-n1cccn1
Cc1cn[nH]c1-c1nc(N)c2[nH]c(=O)n(Cc3ccccc3)c2n1
CN(C)CCOc1ccc(Cn2c3nc(nc(N)c3[nH]c2=O)-c2nc(c[nH]2)C2CC2)cn1
Nc1nc(nc2n(Cc3cccc(c3)C(=O)N3CCCC3)c(=O)[nH]c12)-c1nnc[nH]1
COC(=O)COc1ccc(Cn2c3nc(nc(N)c3[nH]c2=O)-c2ncc[nH]2)cn1
Nc1nc(nc2n(Cc3ccc(OCC(O)=O)nc3)c(=O)[nH]c12)-c1ncc[nH]1
Nc1nc(nc2n(Cc3ccc4CCNCc4c3)c(=O)[nH]c12)-c1nc(c[nH]1)C1CC1
CN1CCN(CCCCCn2c3nc(nc(N)c3[nH]c2=O)-c2ncc[nH]2)CC1
Nc1nc(nc2n(CCCCCCN3CCCC3)c(=O)[nH]c12)-c1nc(c[nH]1)C1CC1
Nc1nc(nc2n(CC3CCOCC3)c(=O)[nH]c12)-c1ncc[nH]1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(ccc1C)C(=O)NC1(COC1)c1ccccc1)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(ccc1C)C(=O)NC1(COC1)c1ccccn1)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(C(=O)NC2(COC2)c2ccccn2)c(OC)cc1C)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(cc(F)c1C)C(=O)NC1(COC1)c1ccccn1)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(ccc1C)C(=O)NC1(COC1)c1ncccn1)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(C(=O)NC2(COC2)c2ncccn2)c(OC)cc1C)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(c(F)c12)-c1cc(cc(F)c1C)C(=O)NC1(COC1)c1ncccn1)-c1ccc(F)cc1
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(O)C#C |r|
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@]1(O)C#C
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(F)C#C |r|
CC#C[C@@]1(F)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
C[C@@]1(F)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
CC#C[C@@]1(O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
C[C@@]1(O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
CNC(=O)c1c(oc2cc(N(CCO)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CC(=O)N(C)[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CCCC(O)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(C[C@@H](CO)O[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(C(CS(C)(=O)=O)COC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(C[C@@H](CO)O[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(Cc4nnnn4C(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCOC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCC[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(nc2cc3N(CCCC(C)c3cn12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCC(C)c3cc12)S(C)(=O)=O)-c1ccc(Oc2ccc(F)cc2)cc1
CNC(=O)c1c(oc2cc3N(CCCC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1F
CNC(=O)c1c(oc2cc3N(CCCC(C)c3cc12)S(C)(=O)=O)-c1ccccc1F
CNC(=O)c1c(oc2cc3N(C(CO)COC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(C[C@@H](CS(C)(=O)=O)O[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(C[C@@H](CS(C)(=O)=O)O[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC(CS(C)(=O)=O)OC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CC(CO)OC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CC4(CC4)O[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC4(CC4)OC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(Cc4cnnn4[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(Cc4nccn4C(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CC(=O)N(C)[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC(=O)N[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC(=O)NC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCNC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCO[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
[H][C@@]12C[C@]1([H])c1cc3c(C(=O)NC)c(oc3cc1N(CC2)S(C)(=O)=O)-c1ccc(F)cc1 |r|
[H][C@]12C[C@@]1([H])c1cc3c(C(=O)NC)c(oc3cc1N(CC2)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CCCC4(CC4)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCC[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CCCC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCC(=C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCCc3cc12)C(=O)OC)-c1ccc(F)cc1
CS(=O)(=O)N1CCCCc2cc3c(-c4ncn[nH]4)c(oc3cc12)-c1ccc(F)cc1
CN(O)C(=O)c1c(oc2cc3N(CCCCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CONC(=O)c1c(oc2cc3N(CCCCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCCCCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCCCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(Cc4cnnn4C(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCCc3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1OC
CNC(=O)c1c(oc2cc3N(C[C@H](CS(C)(=O)=O)O[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(C[C@H](CO)O[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC4(CC4)O[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(Cc4cnnn4[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC(=O)N[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CCO[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CCC4CC4c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCC=C(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |t:13|
CNC(=O)c1c(oc2cc3N(CCCCc3cc12)S(=O)(=O)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CC(=O)N(C)C(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(C[C@H](CO)O[C@@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(nn2cc3N(CCCC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(C[C@H](CS(C)(=O)=O)O[C@H](C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc3N(CC(C)OC(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCN(C)C(C)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc3N(CCCC(=O)c3cc12)S(C)(=O)=O)-c1ccc(F)cc1
CS(=O)(=O)N1CCCCc2cc3c(-c4ncc[nH]4)c(oc3cc12)-c1ccc(F)cc1
c1cc(ccc1C2=NC(=C(C(=O)N2)O)C(=O)O)Cl
COc1cccc(c1)-n1cc(Cn2ccc3nc(nc3c2)-c2ccccc2F)nn1
Fc1ccc(cc1)-n1cc(Cn2ccc3nc(nc3c2)-c2ccccc2F)nn1
Fc1ccccc1-c1nc2ccn(Cc3cn(nn3)-c3ccccc3)cc2n1
Cc1cc(C)n2nc(Cn3cc(Cn4ccc5nc(nc5c4)-c4ccccc4F)nn3)nc2n1
Fc1ccccc1-c1nc2ccn(Cc3cn(Cc4cn5cccnc5n4)nn3)cc2n1
Fc1ccccc1-c1nc2ccn(Cc3ccc(nn3)-c3ccc(cc3C(F)(F)F)C(F)(F)F)cc2n1
Fc1ccccc1-c1nc2ccn(Cc3cn(nn3)-c3ccc(Cn4ccccc4=O)cc3)cc2n1
Fc1ccccc1-c1nc2ccn(Cc3cn(nn3)-c3ccccc3F)cc2n1
CS(=O)(=O)Nc1ccc(cc1)-n1cc(Cn2ccc3nc(nc3c2)-c2ccccc2F)nn1
Cc1cc(C)n2cc(Cn3cc(Cn4ccc5nc(nc5c4)-c4ccccc4F)nn3)nc2n1
Fc1ccccc1-c1nc2ccn(Cc3cn(nn3)-c3ccc(Cn4cccnc4=O)cc3)cc2n1
COc1ccc(cc1)-n1cc(Cn2ccc3nc(nc3c2)-c2ccccc2F)nn1
C[C@@H](C(=O)OC(C)C)N[P@](=O)(OC[C@@H]1[C@H]([C@@]([C@@H](O1)N2C=CC(=O)NC2=O)(C)F)O)Oc3ccccc3
CN(C)S(=O)(=O)NC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n3CCOc1c23
COC(=O)NC(C(C)C)C(=O)N1CCCC1c1ncc([nH]1)-c1ccc2-c3c(F)c4cc(ccc4n3COc2c1)-c1cnc([nH]1)C1CCCN1C(=O)C(NC(=O)OC)C(C)C
Nc1ccn([C@@H]2O[C@H](CO[P@@](O)(=O)O[P@@](O)(=O)OP(O)(O)=O)C[C@H]2O)c(=O)n1 |r|
C[C@@]1(O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c(N)ncnc12 |r|
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H](C[C@H](O3)CO[P@](=O)(O)O[P@@](=O)(O)OP(=O)(O)O)O)N
C[C@@]1(O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(N)nc1=O |r|
C[C@@]1(F)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(N)nc1=O |r|
C[C@H]1CC[C@@H](CC1)n1nncc1-c1cc(sc1C(O)=O)-c1ccccc1 |r,wU:4.7,wD:1.0,(-.54,-30.31,;.79,-29.54,;2.13,-30.31,;3.45,-29.53,;3.45,-27.99,;2.11,-27.23,;.78,-28,;4.78,-27.22,;6.02,-28.13,;7.26,-27.22,;6.78,-25.76,;5.24,-25.77,;4.33,-24.52,;2.79,-24.57,;2.27,-23.12,;3.49,-22.17,;4.77,-23.04,;6.11,-22.27,;7.43,-23.05,;6.11,-20.73,;.93,-22.36,;.92,-20.82,;-.42,-20.06,;-1.75,-20.84,;-1.73,-22.39,;-.39,-23.14,)|
Cc1ccc(cc1)-n1nncc1-c1cc(sc1C(O)=O)-c1ccccc1
CC(C)N(C(=O)[C@H]1CC[C@H](C)CC1)c1cc(sc1C(O)=O)-c1ccccc1 |r,wU:9.9,wD:6.5,(-.82,9.12,;-1.74,7.89,;-3.27,8.07,;-1.13,6.48,;.41,6.48,;1.18,5.14,;1.18,7.81,;2.71,7.87,;3.43,9.24,;2.6,10.54,;3.37,11.87,;1.06,10.47,;.35,9.11,;-2.06,5.24,;-3.6,5.26,;-4.09,3.8,;-2.86,2.88,;-1.6,3.77,;-.14,3.28,;1.02,4.29,;.16,1.77,;-5.43,3.03,;-6.76,3.8,;-8.09,3.03,;-8.09,1.49,;-6.76,.72,;-5.43,1.49,)|
COP(=O)(OC)OP(=O)(OC)OP(=O)(OC)OC[C@H]1O[C@@H](n2ccc3c(N)nc(N)nc23)[C@](C)(F)[C@@H]1O |r|
COP(=O)(OC)OP(=O)(OC)OP(=O)(OC)OC[C@H]1O[C@@H](n2ccc3c(N)ncnc23)[C@](C)(F)[C@@H]1O |r|
COP(=O)(OC)OP(=O)(OC)OP(=O)(OC)OC[C@H]1O[C@@H](n2cc(F)c3c(N)ncnc23)[C@](C)(F)[C@@H]1O |r|
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5ccccc5CCCn4c3c2)cc1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5ncoc5CCCn4c3c2)cc1
Cc1nc-2c(CCCn3c-2c(C2CCCCC2)c2ccc(cc32)C(=O)NC2(CCCC2)C(=O)Nc2ccc(\C=C\C(O)=O)cc2)s1
Nc1nc-2c(CCCn3c-2c(C2CCCCC2)c2ccc(cc32)C(=O)NC2(CCCC2)C(=O)Nc2ccc(\C=C\C(O)=O)cc2)s1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5nccnc5CCCn4c3c2)cc1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5ncccc5OCCn4c3c2)cc1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5cccnc5OCCn4c3c2)cc1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5ccoc5CCCn4c3c2)cc1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5ncccc5NC(=O)Cn4c3c2)cc1
OC(=O)\C=C\c1ccc(NC(=O)C2(CCCC2)NC(=O)c2ccc3c(C4CCCCC4)c4-c5cccnc5CCCn4c3c2)cc1
Brc1ccc(cc1)-c1nc(SCCC(=O)Oc2ccccc2)[nH]c(=O)c1C#N
Cc1cccc(CSc2nc(-c3ccc(Cl)cc3Cl)c(C#N)c(=O)[nH]2)c1
CCCCCSc1nc(-c2ccc(Br)cc2)c(C#N)c(=O)[nH]1
Cc1cccc(CSc2nc(-c3ccccc3C(F)(F)F)c(C#N)c(=O)[nH]2)c1
Cc1cccc(CSc2nc(-c3cccc(c3)C(F)(F)F)c(C#N)c(=O)[nH]2)c1
COc1cc(CSc2nc(-c3ccc(Br)cc3)c(C#N)c(=O)[nH]2)cc(OC)c1
FC(F)(F)Oc1ccc(CSc2nc(-c3ccc(Cl)cc3Cl)c(C#N)c(=O)[nH]2)cc1
FC(F)(F)c1ccccc1-c1nc(SCc2ccccc2Br)[nH]c(=O)c1C#N
Clc1ccc(c(Cl)c1)-c1nc(SCCCc2ccccc2)[nH]c(=O)c1C#N
CCCCCSc1nc(-c2ccc(cc2)C(C)C)c(C#N)c(=O)[nH]1
CC(C)c1ccc(cc1)-c1nc(SCc2ccc(OC(F)(F)F)cc2)[nH]c(=O)c1C#N
CC(C)c1ccc(cc1)-c1nc(SCc2ccccc2Br)[nH]c(=O)c1C#N
CC(C)c1ccc(cc1)-c1nc(SCc2cccc(C)c2)[nH]c(=O)c1C#N
CC(C)c1ccc(cc1)-c1nc(SCc2cccc(c2)[N+]([O-])=O)[nH]c(=O)c1C#N
COc1cc(CSc2nc(-c3ccc(cc3)C(C)C)c(C#N)c(=O)[nH]2)cc(OC)c1
COc1cc(CSc2nc(-c3cccc(c3)C(F)(F)F)c(C#N)c(=O)[nH]2)cc(OC)c1
Cc1cccc(CSc2nc(-c3ccc(F)cc3F)c(C#N)c(=O)[nH]2)c1
CCCCCSc1nc(-c2cccc(c2)C(F)(F)F)c(C#N)c(=O)[nH]1
Cc1ccccc1-c1nc(SCc2ccccc2Br)[nH]c(=O)c1C#N
COc1cc(CSc2nc(-c3cccc(C)c3)c(C#N)c(=O)[nH]2)cc(OC)c1
Cc1cccc(CSc2nc(-c3ccc(Br)cc3)c(C#N)c(=O)[nH]2)c1
CC(C)c1ccc(cc1)-c1nc(SCC2CCCCO2)[nH]c(=O)c1C#N
FC(F)(F)c1cccc(c1)-c1nc(SCCC(=O)Oc2ccccc2)[nH]c(=O)c1C#N
CCCCCSc1nc(-c2cccc(C)c2)c(C#N)c(=O)[nH]1
CCCCCSc1nc(-c2ccc(Cl)cc2Cl)c(C#N)c(=O)[nH]1
CCCCCSc1nc(-c2ccc(F)cc2F)c(C#N)c(=O)[nH]1
Cc1cccc(CSc2nc(-c3cc(Cl)cc(Cl)c3)c(C#N)c(=O)[nH]2)c1
FC(F)(F)Oc1ccc(CSc2nc(-c3ccccc3C(F)(F)F)c(C#N)c(=O)[nH]2)cc1
COc1cc(CSc2nc(-c3ccccc3C(F)(F)F)c(C#N)c(=O)[nH]2)cc(OC)c1
COc1cc(CSc2nc(-c3cc(F)cc(F)c3)c(C#N)c(=O)[nH]2)cc(OC)c1
[O-][N+](=O)c1cccc(CSc2nc(-c3cccc(c3)C(F)(F)F)c(C#N)c(=O)[nH]2)c1
Cc1cccc(c1)-c1nc(SCc2cccc(c2)[N+]([O-])=O)[nH]c(=O)c1C#N
Cc1cccc(CSc2nc(-c3cccc(C)c3)c(C#N)c(=O)[nH]2)c1
FC(F)(F)Oc1ccc(CSc2nc(-c3ccc(Br)cc3)c(C#N)c(=O)[nH]2)cc1
COc1cc(CSc2nc(-c3ccccc3C)c(C#N)c(=O)[nH]2)cc(OC)c1
Brc1ccc(cc1)-c1nc(SCC2CCCCO2)[nH]c(=O)c1C#N
FC(F)(F)c1ccccc1CSc1nc(-c2ccc(Br)cc2)c(C#N)c(=O)[nH]1
COc1cc(CSc2nc(-c3ccc(Cl)cc3Cl)c(C#N)c(=O)[nH]2)cc(OC)c1
Fc1ccc(c(F)c1)-c1nc(SCc2ccccc2Br)[nH]c(=O)c1C#N
CCCCCSc1nc(-c2ccccc2C(F)(F)F)c(C#N)c(=O)[nH]1
Cc1ccccc1-c1nc(SCc2cccc(c2)[N+]([O-])=O)[nH]c(=O)c1C#N
Cc1cccc(c1)-c1nc(SCc2ccc(OC(F)(F)F)cc2)[nH]c(=O)c1C#N
[O-][N+](=O)c1cccc(CSc2nc(-c3ccc(Br)cc3)c(C#N)c(=O)[nH]2)c1
[O-][N+](=O)c1cccc(CSc2nc(-c3ccc(F)cc3F)c(C#N)c(=O)[nH]2)c1
Brc1ccc(cc1)-c1nc(SCc2ccccc2Br)[nH]c(=O)c1C#N
COc1cc(CSc2nc(-c3cc(Cl)cc(Cl)c3)c(C#N)c(=O)[nH]2)cc(OC)c1
Cc1cccc(CSc2nc(-c3cc(F)cc(F)c3)c(C#N)c(=O)[nH]2)c1
CCCCCSc1nc(-c2ccccc2C)c(C#N)c(=O)[nH]1
COc1cc(CSc2nc(-c3ccc(F)cc3F)c(C#N)c(=O)[nH]2)cc(OC)c1
Cc1cccc(CSc2nc(-c3ccccc3C)c(C#N)c(=O)[nH]2)c1
CCCC1(CC(O)=O)OCCC2C1Nc1c2c(CC)ccc1Cl
CN(C)CCCn1c(N)nc2ccccc12
CN(C)CCCn1c(N)nc2ccc3OC(CN(C)C)Cc3c12
CN(C)CC1CNc2nc3ccc4OCC(CN(C)C)Cc4c3n2C1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
OC(=O)C(\O)=C\C(=O)c1cccc(OCc2cc(Cl)cc(Cl)c2C#N)c1
Nc1cc(Cn2c(C(O)=O)c(-c3ccc[nH]c3=O)c3ccc(Cl)cc23)ccn1 |(7.03,-10.36,;7.79,-11.7,;9.33,-11.72,;10.07,-13.06,;11.62,-13.08,;12.4,-11.75,;13.93,-11.91,;14.71,-13.24,;13.94,-14.58,;16.25,-13.24,;14.55,-10.5,;16.05,-10.18,;17.09,-11.33,;18.59,-11,;19.07,-9.54,;18.03,-8.39,;16.52,-8.71,;15.49,-7.57,;13.41,-9.48,;13.4,-7.93,;12.06,-7.16,;10.73,-7.93,;9.4,-7.16,;10.73,-9.48,;12.08,-10.25,;9.3,-14.39,;7.76,-14.38,;7,-13.03,)|
Cc1ccc2c(c(C(=O)NS(=O)(=O)C3CC3)n(Cc3cc(F)ccc3F)c2c1)-c1ccc[nH]c1=O |(25.71,-7.97,;27.04,-8.74,;28.37,-7.96,;29.71,-8.73,;29.71,-10.28,;30.86,-11.3,;30.24,-12.71,;31.01,-14.04,;32.55,-14.03,;30.25,-15.38,;31.02,-16.7,;32.35,-15.92,;32.36,-17.46,;30.26,-18.04,;28.93,-18.82,;30.27,-19.59,;28.71,-12.55,;27.92,-13.88,;26.38,-13.86,;25.64,-12.52,;24.1,-12.5,;23.34,-11.16,;23.31,-13.83,;24.07,-15.17,;25.61,-15.18,;26.37,-16.52,;28.39,-11.05,;27.04,-10.28,;32.36,-10.98,;33.39,-12.12,;34.89,-11.8,;35.37,-10.34,;34.34,-9.19,;32.82,-9.51,;31.79,-8.37,)|
Cc1cc2c(cc1F)n(c(c2C3=CC=CNC3=O)C(=O)NS(=O)(=O)C4CC4)Cc5cc(ccc5F)F
CS(=O)(=O)Nc1cccc(c1)S(=O)(=O)NC(=O)c1c(-c2ccc[nH]c2=O)c2ccc(Cl)cc2n1Cc1ccnc(N)c1 |(15.23,-36.58,;14.44,-35.25,;14.44,-33.71,;15.77,-34.47,;12.91,-35.27,;12.13,-33.95,;10.57,-33.96,;9.79,-32.62,;10.56,-31.28,;12.1,-31.28,;12.88,-32.6,;12.87,-29.94,;14.2,-29.16,;14.2,-30.7,;12.09,-28.61,;12.86,-27.28,;14.4,-27.27,;12.08,-25.95,;12.7,-24.54,;14.2,-24.22,;15.24,-25.36,;16.73,-25.04,;17.21,-23.58,;16.18,-22.43,;14.67,-22.75,;13.64,-21.61,;11.56,-23.52,;11.55,-21.97,;10.22,-21.2,;8.89,-21.97,;7.55,-21.2,;8.89,-23.52,;10.23,-24.29,;10.55,-25.79,;9.77,-27.12,;8.23,-27.1,;7.46,-28.42,;5.92,-28.41,;5.16,-27.06,;5.94,-25.74,;5.19,-24.4,;7.48,-25.76,)|
CC1COc2cc3c(c(C(=O)NS(C)(=O)=O)n(Cc4cc(F)ccc4F)c3cc12)-c1ccc[nH]c1=O |(21.41,-24.4,;22.91,-24.06,;23.53,-22.66,;25.05,-22.81,;25.38,-24.31,;26.73,-25.08,;26.73,-26.63,;27.88,-27.65,;27.26,-29.06,;28.03,-30.39,;29.57,-30.39,;27.27,-31.73,;28.04,-33.05,;27.27,-34.4,;29.37,-32.28,;29.38,-33.82,;25.73,-28.9,;24.94,-30.23,;23.4,-30.21,;22.65,-28.87,;21.11,-28.85,;20.36,-27.51,;20.32,-30.18,;21.09,-31.53,;22.63,-31.54,;23.39,-32.88,;25.4,-27.4,;24.06,-26.63,;24.06,-25.08,;29.38,-27.33,;30.41,-28.47,;31.91,-28.15,;32.39,-26.69,;31.36,-25.54,;29.85,-25.86,;28.81,-24.72,)|
OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
ON1C(C(c2ccccc2)c2ccccc2C1=O)C(O)=O
On1c(nc2ccccc2c1=O)C(=O)NCCCc1ccccc1
Clc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1Cl |w:5.4|
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(Cl)ccc2-c2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(Cl)ccc2-c2ccc(Cl)cc2)cc1
CN(C(C)=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(ccc2-c2ccc(Cl)cc2)N2CCCC2=O)cc1F
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2-c2ccccc2)cc1F
OC1CCN(CC1)C(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
Cc1ccc(cc1)-c1ccc(Cl)cc1COc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
CN(C)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
CN(C)S(=O)(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
OC(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
CCN(C(C)=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
CN(C)C(=O)c1ccc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(c1)-c1ccc(Cl)cc1
CN(C)C(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2-c2ccccc2)cc1Cl
CC(=O)Nc1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2-c2ccccc2)cc1C(F)(F)F
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cccnc2-c2ccc(Cl)cc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2-c2ccc(Cl)cc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(ccc2-c2ccc(Cl)cc2)C#N)cc1
CC(C)C(=O)N(C)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
CCCNC(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
CC(C)N(C(C)=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
OCCNC(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
CNC(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(ccc2-c2ccc(Cl)cc2)C(=O)N2CCCCC2)cc1F
CC(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
CC(=O)NC(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
NC(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
CNC(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
COc1cc(OCc2ccccc2-c2ccccc2)ccc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
Cc1nc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(o1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(Cl)ccc2-c2cccc(Cl)c2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(Cl)ccc2-c2cccnc2)cc1
Cc1ncc(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c(n1)-c1ccc(Cl)cc1
Cc1nc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(s1)-c1ccc(Cl)cc1
COc1ccc(cc1)-c1ccc(Cl)cc1COc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
NC(=O)c1ccc(cc1)-c1ccc(Cl)cc1COc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc(cc1)-c1ccc(Cl)cc1COc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(ccc2-c2ccc(Cl)cc2)C(=O)NCc2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(ccc2-c2ccc(Cl)cc2)C(=O)N2CCOCC2)cc1F
CN(C)C(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2-c2ccccc2)c(F)c1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ncccc2-c2ccc(Cl)cc2)cc1
Cc1nc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)s1)-c1ccc(Cl)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cc(Cl)ccc2-c2ccc(cc2)C#N)cc1
CN(C)C(=O)Nc1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
COc1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
NS(=O)(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
CC(C)NC(=O)c1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cccc(Oc3ccc(Cl)cc3)c2)C1=O |r|
OC(=O)[C@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cccc(Oc3ccc(Cl)c(Cl)c3)c2)C1=O |r|
CNC(=O)c1c(oc2cc(N(Cc3ccc(B(O)O)c(F)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]11CCO1 |r|
COc1nc(N)nc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@@]1(C)F |r|
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@]11CCO1 |r|
Nc1ccn([C@@H]2O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@]22CCCO2)c(=O)n1 |r|
C[C@@]1(F)[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O |r|
Nc1ccn([C@@H]2O[C@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@]22CCO2)c(=O)n1 |r|
CN1c2c(nn(c2-c2ccccc2S1(=O)=O)-c1cccc(Cl)c1)C(=O)Nc1ccc(NS(C)(=O)=O)cc1
[H][C@]12OC[C@](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)(O[C@H]1n1cnc3c(N)ncnc13)[C@H]2O |r,THB:32:31:2.3:20.19|
[H][C@]12OC[C@@](O[C@H]1n1cnc3c1nc(N)[nH]c3=O)(C(C)OP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@H]2O |r,THB:34:33:2.3:6.5|
[H][C@]12OC[C@](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)(O[C@H]1n1cnc3c1nc(N)[nH]c3=O)[C@H]2O |r,THB:33:32:3.2:19.20|
[H][C@]12OCC[C@](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)(O[C@H]1n1cnc3c1nc(N)[nH]c3=O)[C@H]2O |r,THB:34:33:2.3.4:21.20|
C[C@]12OC[C@](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)(O[C@H]1n1cnc3c1nc(N)[nH]c3=O)[C@H]2O |r,THB:33:32:19.20:3.2|
[H][C@]12OC[C@](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)(O[C@H]1n1ccc(N)nc1=O)[C@H]2O |r,THB:30:29:2.3:20.19|
[H][C@]12OC[C@](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)(O[C@H]1n1ccc(=O)[nH]c1=O)[C@H]2O |r,THB:30:29:2.3:20.19|
OCc1c(O)c(ncc1NC(=O)Cc1ccc(F)c(Cl)c1)C(=O)NO
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ccn3c(cc4c(F)cccc34)c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2CCCCn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2-c3cc4c(F)cccc4n3CCn2c(=O)c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2Cn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2CCn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2CCCn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2NCn3c(cc4c(F)cccc34)-c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn3c(cc4c(F)cccc34)c2n1)-c1ccc(F)cc1
COc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(Cl)cc3)C2=O)cc1
COc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccc(Cl)cc2)cc1 |t:9|
COc1ccc(cc1)N1CN=c2s\c(=C\c3ccccc3)c(=O)n2C1 |t:11|
Clc1ccc(\C=C2/SC(=O)N(CC(=O)Nc3ccccc3)C2=O)c(Cl)c1
Clc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccccc3Cl)C2=O)cc1
CC1CCC(CC1)C(=O)N(C1CCC(O)CC1)c1cc(sc1C([O-])=O)-c1ccccc1 |(6.43,-41.83,;5.09,-42.6,;5.08,-44.14,;3.76,-44.9,;2.43,-44.12,;2.42,-42.59,;3.76,-41.83,;1.09,-44.89,;1.09,-46.43,;-.24,-44.12,;-.24,-42.58,;-1.57,-41.82,;-1.57,-40.28,;-.24,-39.5,;-.24,-37.96,;1.09,-40.28,;1.09,-41.82,;-1.48,-45.04,;-2.96,-44.58,;-3.85,-45.84,;-2.93,-47.07,;-1.48,-46.59,;-.67,-47.9,;-1.41,-49.26,;.87,-47.87,;-5.39,-45.84,;-6.16,-44.51,;-7.7,-44.51,;-8.46,-45.85,;-7.68,-47.18,;-6.15,-47.17,)|
N=C1S\C(=C/c2ccccc2)C(=O)N1c1ccccc1
COc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(Cl)cc3Cl)C2=O)cc1
COc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccccc3)C2=O)cc1
Fc1ccc(\C=C2/SC(=O)N(CC(=O)Nc3ccc(Cl)cc3)C2=O)cc1
COc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(OC)cc3)C2=O)cc1
COc1ccc(\C=C2/SC(=O)N(CC(=O)Nc3ccc(Cl)cc3)C2=O)cc1
Clc1ccccc1\C=C1/SC(=O)N(CC(=O)Nc2ccccc2)C1=O
O=C(CN1C(=O)S\C(=C/c2ccccc2)C1=O)Nc1ccccc1
Fc1ccc(\C=C2/SC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1
Clc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(Cl)cc3)C2=O)cc1
O=C(C\N=C1\S\C(=C/c2ccccc2)C(=O)N1c1ccccc1)Nc1ccccc1
O=c1n2CN(CN=c2s\c1=C\c1ccccc1)c1ccccc1 |c:6|
Clc1ccccc1\C=c1\sc2=NCN(Cn2c1=O)c1ccccc1 |t:11|
Clc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccccc2)c(Cl)c1 |t:8|
Clc1ccc(cc1)N1CN=c2s\c(=C\c3ccccc3)c(=O)n2C1 |t:10|
Clc1ccc(cc1)N1CN=c2s\c(=C\c3ccccc3Cl)c(=O)n2C1 |t:10|
Clc1ccc(cc1)N1CN=c2s\c(=C\c3ccc(Cl)cc3Cl)c(=O)n2C1 |t:10|
COc1ccc(cc1)N1CN=c2s\c(=C\c3ccc(F)cc3)c(=O)n2C1 |t:11|
COc1ccc(cc1)N1CN=c2s\c(=C\c3ccc(Cl)cc3Cl)c(=O)n2C1 |t:11|
COc1ccc(\C=C2/SC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1
COc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(F)cc3)C2=O)cc1
Fc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccccc2)cc1 |t:8|
COc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccccc2)cc1 |t:9|
Fc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccc(Cl)cc2)cc1 |t:8|
COc1ccc(cc1)N1CN=c2s\c(=C\c3ccc(Cl)cc3)c(=O)n2C1 |t:11|
COc1ccc(cc1)N1CN=c2s\c(=C\c3ccccc3Cl)c(=O)n2C1 |t:11|
Clc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccccc2)cc1 |t:8|
COc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccc(OC)cc2)cc1 |t:9|
Clc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccc(Cl)cc3Cl)C2=O)cc1
COc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccccc3Cl)C2=O)cc1
Clc1ccc(NC(=O)CN2C(=O)S\C(=C/c3ccccc3)C2=O)cc1
Clc1ccc(\C=c2\sc3=NCN(Cn3c2=O)c2ccc(Cl)cc2)cc1 |t:8|
Clc1ccc(\C=C2/SC(=O)N(CC(=O)Nc3ccccc3)C2=O)cc1
[H][C@@]12C[C@@]1(Cn1c(c(C3CCCCC3)c3ccc(cc13)C(=O)NS(=O)(=O)N(C)C)-c1ccc(OC)cc21)C(=O)N1[C@@]2([H])CC[C@]1([H])CN(C)C2 |r,TLB:37:39:46.47.49:43.42,THB:48:47:39:43.42|
Cn1c(c(C2CCCCC2)c2sc(cc12)C(O)=O)-c1ccccc1
CCNc1cc2oc(c(C(=O)NC)c2cc1-c1ccc(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1
CCN(C(=O)C(F)(F)F)c1cc2oc(c(C(=O)NC)c2cc1-c1ccc(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1
CNC(=O)c1c(oc2ccc(cc12)-c1cccc(c1)C(=O)NC1(CC1)c1ccccn1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(CCO)S(C)(=O)=O)c(cc12)-c1cccc(c1)C(=O)NC1(CC1)c1ccccn1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(CCO)S(C)(=O)=O)c(cc12)-c1cccc(c1)C(=O)NC1(CC1)c1ccccc1)-c1ccc(F)cc1
CCN(c1cc2oc(c(C(=O)NC)c2cc1-c1cccc(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1)S(C)(=O)=O
CCN(c1cc2oc(c(C(=O)NC)c2cc1-c1ccc(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1)S(C)(=O)=O
CCN(C(=O)OC)c1cc2oc(c(C(=O)NC)c2cc1-c1ccc(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1
CCN(C(C)=O)c1cc2oc(c(C(=O)NC)c2cc1-c1ccc(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1
CCN(c1cc2oc(c(C(=O)NC)c2cc1-c1cc(Cl)c(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1)S(C)(=O)=O
CCN(c1cc2oc(c(C(=O)NC)c2cc1-c1cc(F)c(F)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1)S(C)(=O)=O
CCN(c1cc2oc(c(C(=O)NC)c2cc1-c1cc(C)c(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1)S(C)(=O)=O
CCN(C(=O)N(C)C)c1cc2oc(c(C(=O)NC)c2cc1-c1ccc(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1
CCN(c1cc2oc(c(C(=O)NC)c2cc1-c1cc(F)c(OC)c(c1)C(=O)NC1(CC1)c1ncccn1)-c1ccc(F)cc1)S(C)(=O)=O
COC[C@H]1C[C@](CC(C)C)(N([C@H]1C(=O)OC)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1c1nccs1)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O
CCOC(=O)c1csc(n1)[C@H]1[C@@H](COC)C[C@](CC(C)C)(N1C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
[H][C@@]1(COC(=O)O1)[C@@]1([H])[C@@H](COC)C[C@](CC(C)C)(N1C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1C(N)=O)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
CC[C@H]1[C@@H](COC)C[C@](CC(C)C)(N1C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1COC(C)=O)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1CF)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1CNC(C)=O)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
[H][C@@]1(COC(C)(C)O1)[C@@]1([H])[C@@H](COC)C[C@](CC(C)C)(N1C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@@H]1c1nccs1)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1COC)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1CN=[N+]=[N-])C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1COCC=C)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
COC[C@H]1C[C@](CC(C)C)(N([C@H]1COC(=O)OC)C(=O)c1ccc(c(OC)c1)C(C)(C)C)C(O)=O |r|
CNC(=O)c1c(oc2cc(N3[C@H](COC3=O)c3ccc(B(O)O)c(F)c3)c(cc12)C1CC1)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc(N(c3ccc(cc3)B(O)O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(c3ccc(B(O)O)c(c3)C(F)(F)F)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3C(COC3=O)c3ccc(cc3)B(O)O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(-c3ncnn3-c3ccc(B(O)O)c(F)c3)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(c(cc12)C1CC1)-n1nccc1-c1ccc(B(O)O)c(F)c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(-c3ncoc3-c3ccc(B(O)O)c(F)c3)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3C(CCOC3=O)c3ccc(cc3)B(O)O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3[C@H](COC3=O)c3cccc(F)c3)c(cc12)C1CC1)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc(c(cc12)C1CC1)-n1ncnc1-c1ccc(B(O)O)c(F)c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(c(cc12)C1CC1)-n1nnnc1-c1ccc(B(O)O)c(Cl)c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(c3cccc(c3)B(O)O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(c3ccc(B(O)O)c(F)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(c3cc4COB(O)c4c(Cl)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(Cc3ccc(cc3C(F)(F)F)B(O)O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C3CCCc4cc(ccc34)B(O)O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C3CCc4c3cccc4B(O)O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3C(CCC3=O)c3ccc(cc3)B(O)O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3C(COC3=O)c3cccc(c3)B(O)O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3[C@@H](COC3=O)c3ccc(B(O)O)c(F)c3)c(cc12)C1CC1)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc(c(cc12)C1CC1)-n1ccnc1-c1ccc(B(O)O)c(F)c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(c(cc12)C1CC1)-n1nc(C)nc1-c1ccc(B(O)O)c(F)c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N3C(CNC3=O)c3ccc(cc3)B(O)O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(c3ccc(B(O)O)c(Cl)c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C3CCc4cc(ccc34)B(O)O)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C(C)c3ccc4B(O)OCc4c3)S(C)(=O)=O)c(cc12)C1CC1)-c1ccc(F)cc1
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(F)Cl |r|
C[C@@]1(O)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
O[C@@H]1[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(F)Cl |r|
C[C@@]1(F)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
O[C@@H]1[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(O)C#C |r|
O[C@@H]1[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(O)CF |r|
O[C@@H]1[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(F)C#C |r|
O[C@@H]1[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(O)C=C |r|
CC[C@@]1(O)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
C[C@@]1(Cl)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O |r|
O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@@H](n2ccc(=O)[nH]c2=O)[C@@]1(O)CF |r|
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](F)(Br)[C@H]1O)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)N[P@@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](F)(Br)[C@H]1O)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](F)(Br)[C@H]1O)Oc1ccccc1 |r|
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1ccc(N)nc1=O |r|
CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@](F)(Br)[C@H]1O)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2cnc3c2nc(N)[nH]c3=O)[C@](F)(Br)[C@H]1O)Oc1ccccc1 |r|
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](CO)[C@@H](O)[C@]1(F)Br |r|
Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@]2(F)Br)c(=O)n1 |r|
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@H](O)[C@@]1(F)Br |r|
CC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2cnc3c(N)ncnc23)[C@](F)(Br)[C@H]1O)Oc1ccccc1 |r|
COP(=O)(Nc1nn(cc1C(O)=O)-c1ccc(cc1)-c1cc2nccc(N)n2n1)c1ccc(C)cc1C
COP(=O)(Nc1nc(sc1C(O)=O)-c1ccc(cc1)-c1cc2nc(C)cc(N)n2n1)c1ccc(C)cc1C
COP(=O)(Nc1nn(cc1C(O)=O)-c1ccc(cc1)-c1cc2nc(C)cc(N)n2n1)c1ccc(C)cc1C
COP(=O)(Nc1nn(cc1C(O)=O)-c1ccc(cc1)-c1cc2ncccn2n1)c1ccc(C)cc1C
COP(=O)(Nc1nc(sc1C(O)=O)-c1ccc(cc1)-c1cc2nccc(N)n2n1)c1ccc(C)cc1C
Cc1ccc(c(C)c1)S(=O)(=O)Nc1cc(sc1C(O)=O)-c1ccccc1
COP(=O)(Nc1nn(cc1C(O)=O)-c1ccc(cc1)-c1cc2nc(C)ccn2n1)c1ccc(C)cc1C
C[C@H]1CC[C@@H](CC1)C(=O)N([C@H]1CC[C@H](O)CC1)c1cc(sc1C(O)=O)C#CC(C)(C)C |r,wU:4.7,10.10,wD:1.0,13.14,(11.71,-9.32,;12.03,-7.81,;13.5,-7.34,;13.82,-5.83,;12.67,-4.8,;11.21,-5.28,;10.89,-6.78,;12.99,-3.3,;14.46,-2.82,;11.85,-2.27,;12.17,-.76,;11.02,.27,;11.34,1.78,;12.81,2.25,;13.13,3.76,;13.95,1.22,;13.63,-.28,;10.38,-2.74,;9.91,-4.21,;8.37,-4.21,;7.89,-2.74,;9.14,-1.84,;9.14,-.3,;10.47,.47,;7.8,.47,;7.46,-5.45,;6.56,-6.7,;5.65,-7.94,;4.75,-9.19,;4.41,-7.04,;6.9,-8.85,)|
C[C@H]1CC[C@@H](CC1)C(=O)N(CC(=O)N1CCOCC1)c1cc(sc1C(O)=O)C#CC(C)(C)C |r,wU:1.0,wD:4.7,(36.38,-2.29,;35.52,-3.57,;36.19,-4.95,;35.33,-6.22,;33.79,-6.11,;33.11,-4.74,;33.98,-3.46,;32.94,-7.39,;33.62,-8.77,;31.4,-7.29,;30.72,-5.91,;29.18,-5.81,;28.33,-7.09,;28.5,-4.43,;29.37,-3.14,;28.7,-1.78,;27.16,-1.67,;26.3,-2.94,;26.98,-4.33,;30.55,-8.57,;29.01,-8.63,;28.58,-10.11,;29.86,-10.97,;31.08,-10.02,;32.4,-10.79,;32.4,-12.33,;33.74,-10.02,;27.14,-10.64,;25.68,-11.17,;24.24,-11.7,;23.06,-10.71,;23.97,-13.22,;22.58,-12.31,)|
C[C@@]1(O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
C[C@]1([C@@H]([C@H](O[C@H]1n2cnc3c2N=C(NC3=O)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F
C[C@@]1(Cl)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
C[C@@]1(O)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@]1(O)C#C |r|
C[C@@]1(F)[C@H](O)[C@@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@](F)(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@]1(F)C#C |r|
C[C@@]1(O)[C@H](F)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
C[C@@]1(F)[C@H](F)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
C[C@@]1(Cl)[C@H](F)[C@@H](COP(O)(=O)OP(O)(=O)OP(O)(O)=O)O[C@H]1n1cnc2c1nc(N)[nH]c2=O |r|
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)N[P@@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1OC(=O)[C@@H](N)C(C)C)Oc1ccccc1 |r|
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1cccc2ccccc12 |r|
CC(C)OC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1OC(=O)[C@@H](N)C(C)C)Oc1cccc2ccccc12 |r|
COc1cccc(O[P@](=O)(N[C@@H](C)C(=O)OC(C)C)OC[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@](Cl)(Br)[C@@H]2O)c1 |r|
CCOC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
CCOC(=O)[C@H](C)N[P@@](=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
COCC(C)OC(=O)[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
C[C@@H](COC(=O)C(C)C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
COCC(C)C(=O)OC[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
COCC(=O)OC[C@H](C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
CC(C)OC(=O)C(C)(C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
CCOC(=O)C(C)(C)NP(=O)(OC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)[C@](Cl)(Br)[C@@H]1O)Oc1ccccc1 |r|
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(C(=O)c2n1)c1ccc(F)cc1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccc(F)cc3)C(=O)c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(Cc3ccccc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2c(cc1F)nnn(Cc1ccc(F)cc1)c2=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2c(cc1Cl)nnn(Cc1ccc(F)cc1)c2=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2c(cc1C)nnn(Cc1ccc(F)cc1)c2=O)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc(OC)c2nnn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc(C)c2nnn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(C(C)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(C(CO)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn([C@H](COC)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn([C@@H](COC)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(Cc3ccc(F)cn3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn(Cc3ccccc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(COC)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(CNC(C)=O)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3)c(=O)c2n1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cn3)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3OC)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3F)c(=O)c2c1)-c1ccc(F)cc1
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n([C@H](COC)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r|
CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n([C@@H](COC)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r|
CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](C(C)C)N(CC)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccc(s1)-c1cc2ccccc2o1)C(=O)c1ccc(Cl)cc1Cl |r|
c1ccc(cc1)C[C@@H](C(=O)O)N(Cc2cccc(c2)C(F)(F)F)C(=O)c3ccc(cc3Cl)Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccc(cc1)-c1nccs1)C(=O)c1ccc(Cl)cc1Cl |r|
Cc1cccc(CN([C@@H](Cc2ccccc2)C(O)=O)C(=O)c2ccc(Cl)cc2Cl)c1 |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccnc1)C(=O)c1ccc(Cl)cc1Cl |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(F)c1)C(=O)c1ccc(Cl)cc1Cl |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(Br)c1)C(=O)c1ccc(Cl)cc1Cl |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccccc1Br)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccc(Br)s1)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccc(cc1)C#N)C(=O)c1ccc(Cl)cc1Cl |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(c1)[N+]([O-])=O)C(=O)c1ccc(Cl)cc1Cl |r|
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccc(Br)cc1)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(Br)c1)C(=O)c1ccc(Cl)cc1
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccc[n+]([O-])c1)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(c1)C#N)C(=O)c1ccc(Cl)cc1Cl
OC(=O)CN(Cc1cccc(Br)c1)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccccc1C#N)C(=O)c1ccc(Cl)cc1Cl |r|
OC(=O)[C@@H](Cc1ccccc1)N(Cc1cccc(Br)c1)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(Br)c1)C(=O)c1ccccc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)c1ccc(Cl)cc1Cl
OC(=O)[C@H](Cc1ccccc1)N(Cc1cccc(Cl)c1)C(=O)c1ccc(Cl)cc1Cl |r|
c1cc(n2c1c(ncn2)N)[C@]3([C@@H]([C@@H]([C@H](O3)CO)O)O)C#N
C[C@]1(O[C@H](CO)[C@@H](O)[C@H]1O)c1ccc2c(N)ncnn12 |r|
Nc1ncnn2c(ccc12)[C@@]1(O[C@H](CO)[C@@H](O)[C@H]1O)C#C |r|
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@@]1(C#N)c1ccc2c(N)ncnn12 |r|
OC(=O)c1ccc(o1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ncc[nH]1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)C1CCCCC1
CCOC(=O)c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
[#6]\[#6](-[#6])=[#6]\c1nc2cc(ccc2n1-[#6]-1-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6](-[#8])=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1cc2ccccc2o1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccccn1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(Br)o1
COc1ccc(CNC(=O)c2ccc3n(C4CCCCC4)c(nc3c2)-c2ccccn2)cc1OC
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc[nH]1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1c[nH]nc1-c1ccccc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)C(=O)c1ccccc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1cccnc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)c1ccc2nc([nH]c2c1)-c1ccccn1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccsc1
COc1ccc(CCNC(=O)c2ccc3n(C4CCCCC4)c(nc3c2)-c2ccccn2)cc1OC
CC(C)n1c(nc2cc(ccc12)C(O)=O)-c1ccccn1
c1cc2c(cc1C(=O)O)ncn2C3CCCCC3
CC1CCC(CC1)n1c(nc2cc(ccc12)C(O)=O)-c1ccccn1 |(-.42,-8.43,;.36,-7.11,;1.9,-7.12,;2.68,-5.79,;1.9,-4.46,;.37,-4.45,;-.4,-5.77,;2.68,-3.13,;1.78,-1.9,;2.68,-.65,;4.14,-1.13,;5.47,-.35,;6.81,-1.12,;6.81,-2.67,;5.47,-3.44,;4.14,-2.67,;8.14,-.33,;9.48,-1.1,;8.12,1.2,;.24,-1.9,;-.53,-.56,;-2.07,-.56,;-2.84,-1.89,;-2.07,-3.23,;-.4,-3.13,)|
Cc1cc(C)c(-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(C)c1 |(1.01,-2.08,;2.55,-2.08,;3.34,-3.41,;4.86,-3.41,;4.86,-4.95,;5.63,-2.1,;7.17,-2.11,;8.08,-.87,;9.54,-1.34,;10.87,-.57,;12.21,-1.34,;12.21,-2.88,;10.87,-3.65,;9.54,-2.88,;8.08,-3.36,;7.54,-4.79,;6.02,-5.05,;5.48,-6.49,;6.46,-7.68,;7.98,-7.43,;8.52,-5.98,;13.56,-.56,;14.89,-1.33,;13.54,.98,;4.88,-.75,;5.65,.58,;3.34,-.75,)|
CNC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1nccs1
Cn1cccc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
CCc1ccc(o1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
CCc1ccc(s1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(c(nc2c1)-c1ccccn1)-c1ccccc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccncc1
CCC(CC)n1c(nc2cc(ccc12)C(O)=O)-c1ccccn1
Cc1[nH]cnc1-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCC3)c(nc2c1)-c1ccccn1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccco1
Cc1cc(oc1C)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OCc1ccc(o1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1cccs1
CC1CCCCC1n1c(nc2cc(ccc12)C(O)=O)-c1ccccn1
OC(=O)c1ccc(s1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
COc1ccc(CCNC(=O)c2ccc3n(C4CCCCC4)c(nc3c2)-c2ccc(OCC(=O)NCCCN(C)C)cc2)cc1OC
Cc1cccc(n1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCCCCC3)c(nc2c1)-c1ccccn1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc2ccccc2n1
CN(C)CCCNC(=O)COc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
Cc1ccc(s1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccc1
Cc1c([nH]c2ccccc12)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(o1)-c1ccc(Cl)cc1
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cccc(COc2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cccc(NC(=O)c2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cc(OCc2ccccc2C#N)ccc1OCCCC#N
OC(=O)C(=O)CC(=O)c1cccc(OCc2cccc(c2)C#N)c1
CCCCCOc1ccccc1C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccc(OCc2cc(Cl)cc(Cl)c2C#N)c1
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2C#N)c1
OC(=O)C(=O)CC(=O)c1cccc(OCc2cccc(Cl)c2C#N)c1
OC(=O)C(=O)CC(=O)c1ccco1
CC(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1ccncc1
OC(=O)C(=O)CC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1
OC(=O)C(=O)CC(=O)c1ccccc1OCc1ccccc1
OC(=O)C(=O)CC(=O)c1ccccc1OCCCC#N
OC(CC(=O)c1ccccc1)C(O)=O
c1ccc(cc1)C(=O)CC(=O)C(=O)O
COC(=O)C(=O)CC(=O)c1ccccc1
CC(C)(C)c1ccc(cc1)C(=O)CC(=O)C(O)=O
CCCOc1ccccc1C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccc(OCCCC#N)c1
OC(=O)C(=O)CC(=O)C(c1ccccc1)c1ccccc1
OC(=O)C(=O)CC(=O)c1ccsc1
CCCCOc1ccccc1C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccc(OCc2cc(Br)ccc2C#N)c1
c1ccc(cc1)CCC(=O)C(=O)O
CC(C)(C)C(=O)CC(=O)C(O)=O
Cc1ccc(cc1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccc(NCc2ccccc2)c1
CCc1ccc(cc1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccnc1
OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)[C@H](Cc1c[nH]c2ccc(cc12)[N+]([O-])=O)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
Cc1[nH]c2ccc(O)cc2c1C[C@H](NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1)C(O)=O
Cn1cc(C[C@@H](NC(=O)c2ccc3n(C4CCCCC4)c(nc3c2)-c2ccoc2)C(O)=O)c2cc(O)ccc12
OC(=O)[C@@H](Cc1c[nH]c2ccc(O)cc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
COc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
OC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)[C@H](Cc1c[nH]c2ccc(cc12)C(O)=O)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
OC(=O)[C@H](Cc1c[nH]c2ccc(NC(=O)C(O)=O)cc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
Cc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
NC(=O)c1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
OC(=O)[C@H](Cc1c[nH]c2ccc(O)cc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
CC(C)(Oc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1)C(O)=O
COc1ccc(cc1OC)[C@@H](C)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)[C@H](Cc1c[nH]c2ccc(cc12)-c1nnn[nH]1)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
OC(=O)COc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
OC(=O)[C@H](Cc1c[nH]c2ccc(O)cc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
OC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
Nc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
COc1ccc(cc1OC)[C@H](C)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1
CS(=O)(=O)Nc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
CC(=O)Nc1ccc2[nH]cc(C[C@H](NC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)C(O)=O)c2c1
COc1ccc(cc1OC)[C@H](NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccccn1)C(O)=O
OC(=O)[C@H](Cc1c[nH]c2ccc(NS(=O)(=O)C(F)(F)F)cc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
OC(=O)[C@H](Cc1c[nH]c2ccc(F)cc12)NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1
Oc1ccc2[nH]cc(CCNC(=O)c3ccc4n(C5CCCCC5)c(nc4c3)-c3ccoc3)c2c1
COc1ccc(cc1OC)[C@H](NC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccoc1)C(O)=O
COC(=O)c1oc(cc(=O)c1O)C(O)=O
CCOC(=O)c1cc(=O)c(O)c(o1)C(O)=O
OC(=O)c1oc2ccccc2c(=O)c1O
OC(=O)c1cc(=O)c(O)c(o1)C(O)=O
CCOC(=O)c1cc(=O)c(O)co1
CCOC(=O)c1cc(=O)c(O)c(o1)C(=O)OCC
CCN(CC)C(=O)c1cc(=O)c(O)c(o1)C(O)=O
OC(=O)c1oc(COCc2ccccc2)cc(=O)c1O
CCOCc1cc(=O)c(O)c(o1)C(O)=O
C1=COC(=C(C1=O)O)C(=O)O
CC(C)(C)OC(=O)c1cc(=O)c(O)c(o1)C(O)=O
CCNC(=O)c1cc(=O)c(O)c(o1)C(O)=O
COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC#C)c(Br)ccc2c1C(F)(F)F
COc1ccc2c(C(=O)NC(CCC(O)=O)C(O)=O)c(F)ccc2c1C(F)(F)F
COc1ccc2c(cccc2c1Br)C(=O)NC(CCC(O)=O)C(O)=O
COc1ccc2ccccc2c1C(=O)NC(CC(O)=O)C(O)=O
COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC(C)(C)C)c(Br)ccc2c1C(F)(F)F
COc1ccc2c(C(=O)NC(CCC(O)=O)C(O)=O)c(Br)ccc2c1C(F)(F)F
COC(=O)N(CC(O)=O)C(=O)c1c(F)ccc2c(c(OC)ccc12)C(F)(F)F
COC(=O)N(CC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
CCOC(=O)N(CC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC(C)C)c(Br)ccc2c1C(F)(F)F
COc1ccc2c(cccc2c1C(F)(F)F)C(=O)NC(CCC(O)=O)C(O)=O
COc1ccc2c(cccc2c1C(F)(F)F)C(=O)NC(CC(O)=O)C(O)=O
COC(=O)N(CC(O)=O)C(=O)c1c(ccc2c(c(OC)ccc12)C(F)(F)F)-c1ccc(Cl)cc1
COC(=O)N(CCC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
COc1ccc2c(cccc2c1Br)C(=O)NC(CC(O)=O)C(O)=O
CCCOC(=O)N(CC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
COc1ccc2c(C(=O)NC(CC(O)=O)C(O)=O)c(Br)ccc2c1C(F)(F)F
COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC=C)c(Br)ccc2c1C(F)(F)F
COC(=O)N(CC(O)=O)C(=O)c1cccc2c(c(OC)ccc12)C(F)(F)F
COc1ccc2c(C(=O)N(C)CC(O)=O)c(Br)ccc2c1C(F)(F)F
COc1ccc2c(C(=O)N(C)CC(O)=O)c(Cl)ccc2c1C(F)(F)F
COC(=O)N(CC(O)=O)C(=O)c1c(Cl)ccc2c(c(OC)ccc12)C(F)(F)F
COc1ccc2c(cccc2c1C(F)(F)F)C(=O)N(CC(O)=O)CC(O)=O
COC(=O)N(CC(O)=O)C(=O)c1c(OC)ccc2c(c(OC)ccc12)C(F)(F)F
COc1ccc2c(C(=O)NC(CC(O)=O)C(O)=O)c(F)ccc2c1C(F)(F)F
COc1nc(nc(C(O)=O)c1O)-c1cccs1
Cn1c(nc(C(O)=O)c(O)c1=O)-c1cccs1
OC(=O)c1nc([nH]c(=O)c1O)-c1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1cccs1
Oc1c(nc([nH]c1=O)-c1cccs1)C(=O)NS(=O)(=O)C(F)(F)F
CS(=O)(=O)c1nc(nc(C(O)=O)c1O)-c1cccs1
Cc1cc(c(C)cc1Cl)S(=O)(=O)Nc1cc(sc1C(O)=O)-c1ccccc1
Cc1ccccc1S(=O)(=O)Nc1cc(sc1C(O)=O)-c1ccncc1
Cc1cc(c(C)cc1Cl)S(=O)(=O)Nc1cc(sc1C(N)=O)-c1ccccc1
OC(=O)c1sc(cc1NS(=O)(=O)c1ccccn1)-c1ccccc1
OC(=O)c1sc(cc1NS(=O)(=O)c1ccccn1)-c1ccc(F)cc1
OC(=O)c1sc(cc1NS(=O)(=O)c1ccc(cn1)C(F)(F)F)-c1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1cccc(O)c1
OC(=O)c1nc([nH]c(=O)c1O)-c1cccc(OCc2ccccc2)c1
COc1c(nc([nH]c1=O)-c1ccc(Cl)cc1)C(O)=O
Cn1c(nc(C(O)=O)c(O)c1=O)-c1cccc(O)c1
COc1nc(nc(C(O)=O)c1O)-c1cccc(O)c1
Oc1cccc(c1)-c1ncc(O)c(=O)[nH]1
COC(=O)c1nc([nH]c(=O)c1O)-c1ccc(Cl)cc1
OC(=O)c1ncnc2n(C3CCCCC3)c(nc12)-c1ccoc1
CCCC(C)Nc1ncnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
COc1cccc(c1)-c1nc2nc[nH]c(=O)c2nc1-c1cccc(OC)c1
COc1ccccc1CCNc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
Brc1ccc(cc1)-c1nc2nc[nH]c(=O)c2nc1-c1ccc(Br)cc1
Fc1ccc(CCNc2ncnc3nc(-c4ccc(F)cc4)c(nc23)-c2ccc(F)cc2)cc1
O=c1[nH]cnc2nc(-c3ccco3)c(nc12)-c1ccoc1
CCCCCCNc1ncnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
Fc1ccc(cc1)-c1nc2ncnc(NC3CCC3)c2nc1-c1ccc(F)cc1
O=c1[nH]cnc2nc3c4ccccc4c4ccccc4c3nc12
Fc1ccc(cc1)-c1nc2ncnc(NCc3ccco3)c2nc1-c1ccc(F)cc1
O=c1[nH]cnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
CCNc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
CC1CCC(CC1)Nc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1 |(8.99,2.68,;7.66,1.91,;6.91,3.26,;5.27,2.64,;4.01,3.06,;4.76,1.7,;6.49,2.33,;2.68,2.28,;2.69,.74,;4.04,-.02,;4.04,-1.57,;2.71,-2.36,;1.38,-1.59,;.05,-2.36,;-1.3,-1.59,;-2.63,-2.36,;-2.61,-3.9,;-3.94,-4.67,;-5.3,-3.9,;-6.63,-4.67,;-5.29,-2.36,;-3.96,-1.59,;-1.28,-.05,;.03,.72,;1.36,-.05,;-2.63,.72,;-2.61,2.26,;-3.94,3.03,;-5.29,2.26,;-6.63,3.01,;-5.27,.7,;-3.94,-.05,)|
CCCC(C)Nc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
Cc1ccc(cc1)-c1nc2nc[nH]c(=O)c2nc1-c1ccc(C)cc1
CCCCCCNc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
O=c1[nH]cnc2nc(-c3ccccn3)c(nc12)-c1ccccn1
CCCCC(CC)CNc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
Fc1ccc(cc1)-c1nc2ncnc(N3CCCCC3)c2nc1-c1ccc(F)cc1
Fc1ccc(cc1)-c1nc2ncnc(NCCc3ccccc3)c2nc1-c1ccc(F)cc1
Cc1ccc(CNc2ncnc3nc(-c4ccc(F)cc4)c(nc23)-c2ccc(F)cc2)cc1
Fc1ccc(cc1)-c1nc2nc[nH]c(=O)c2nc1-c1ccc(F)cc1
CCCCOCCCNc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
Cc1ccc(CNc2ncnc3nc(-c4ccccc4)c(nc23)-c2ccccc2)cc1
Clc1ccccc1-c1nc2nc[nH]c(=O)c2nc1-c1ccccc1Cl
CCNc1ncnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
C1CCCC(CC1)Nc1ncnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
Fc1ccc(CCNc2ncnc3nc(-c4ccccc4)c(nc23)-c2ccccc2)cc1
[O-][N+](=O)c1ccc(cc1)-c1nc2c(nc[n-]c2=[OH+])nc1-c1ccccc1
O=c1[nH]cnc2nc3C4CCCCC4c3nc12
Fc1ccc(cc1)-c1nc2ncnc(NC3CCCCCC3)c2nc1-c1ccc(F)cc1
CCCCOCCCNc1ncnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
CN(C)c1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
C1CCN(CC1)c1ncnc2nc(-c3ccccc3)c(nc12)-c1ccccc1
COc1ccc(cc1)-c1nc2nc[nH]c(=O)c2nc1-c1ccc(OC)cc1
COC(=O)C1CCCN1Nc1ncnc2nc(-c3ccc(F)cc3)c(nc12)-c1ccc(F)cc1
[O-][N+](=O)c1ccc(cc1)-c1nc2nc[n-]c(=[OH+])c2nc1-c1ccccc1
C[N+]1(C)C[C@@]23[C@@H]4[C@@H]5c6c7-c8c5c5c9c%10c%11c%12[C@H]%13[C@H]%14c%15c%16C%17=C%18[C@H]%19[C@@H]%20C(C%21=C2[C@H]2[C@H]%22c(c%21c%16%20)c%15-c%12c%22c%10c5=C42)=C2c4c%19c5c%18c%10c%12c%15c(c%13c%11c%11c%15c(c8c9%11)c8c7c(c4c6[C@]32C1)c5c%128)[C@]%101C[N+](C)(C)C[C@]%14%171 |wU:69.100,63.92,59.83,27.28,17.18,16.61,wD:4.27,22.22,5.47,23.24,28.41,6.10,c:21,26,46,49,(-6.34,1.46,;-5.6,.71,;-6.13,-.2,;-5.05,1.81,;-3.77,1.72,;-4.35,.86,;-4.38,-.91,;-3.85,-1.82,;-2.98,-3.27,;-3,-3.26,;-3.85,-1.81,;-3.31,-.9,;-1.9,-1.47,;-1.01,-.05,;.77,-.07,;1.68,1.38,;3.3,.76,;3.94,1.7,;2.84,3.1,;2.84,2.99,;3.72,1.53,;3.26,.66,;1.89,1.28,;.92,2.86,;-.95,2.76,;-1.43,3.61,;-2.94,3.19,;-3.13,3.36,;-1.56,3.93,;-.02,4.25,;.01,4.14,;1.48,3.63,;1.34,3.61,;.77,2.77,;-1,2.83,;-1.89,1.38,;-3.31,.86,;-3.92,1.75,;-1.81,1.27,;-.96,-.16,;.82,-.23,;1.68,-1.63,;3.11,-1.11,;3.64,-1.98,;2.76,-3.38,;2.75,-3.38,;3.66,-1.97,;3.18,-1.11,;1.66,-1.54,;.74,-2.95,;1.28,-3.88,;-.14,-4.4,;-1.57,-3.83,;-1.01,-2.94,;-.13,-4.42,;-1.55,-3.86,;-.98,-3.02,;-1.85,-1.57,;-3.26,-.98,;-3.23,.76,;-4.53,-.12,;.79,-3.03,;1.3,-3.91,;4.23,-1.12,;5.23,-1.39,;6.22,-.29,;7.27,.76,;7.27,-1.34,;5.34,.92,;4.34,.63,)|
[H][C@@]12C3=C4c5c6c7-c8c9c%10c%11c%12c%13c%14c%15c%16c%17c%13c%13c%11c%11c%10c%10c8[C@]8([H])c%18c%19c%20c%21c(c3c3c1c(c%16c1c3c%21c3c%16c%20c(c%10%18)c%11c%16c%13c%17c13)c%15=C1[C@]2([H])c5c2c7[C@]9([H])[C@]%12([H])[C@@]%143C(C(O)=O)(C(O)=O)[C@]123)[C@@]%191C(C(O)=O)(C(O)=O)[C@]41[C@]68[H] |c:2,t:68|
[H][C@@]12C3=c4c5c6c7c8C(=C9c%10c%11c%12-c%13c%14c%15c%16c%17c%18c(c4c4c5c5c7c7c%19c8[C@]8%20C[N+](C)(C)C[C@]98[C@@]%11([H])[C@]8([H])c%13c9c%11c8c%20c%19c8c%11c%11c(c%159)c%16c9c%18c4c4c9c%11c8c7c54)[C@@]45C[N+](C)(C)C[C@@]34c(c1%10)c%12[C@]%14([H])[C@@]%175[H])[C@@]26[H]
CCCCn1c2ccccc2c(O)c(C2=NS(=O)(=O)c3ccccc3N2)c1=O |t:15|
CCCCCCCCCC[N@@+]1(C)C[C@]23[C@H]4[C@@H]5C6=C7c8c4c4C2=C2[C@H]9[C@H]%10c4c-4c8[C@@H]8[C@@H]%11c%12c-4c%10c4c%10c9c9c2c2c%13c%14c(c5c5c6c6c%15c%16c(c%11c%11c%12c4c4c%10c%10c9c%13c9c%12c%14c5c%15c%12c5c%16c%11c4c5c%109)[C@]64C[N+](C)(C)C[C@@]784)[C@@]32C1 |c:16,t:23|
C[N+]1(C)C[C@]23[C@H]4[C@@H]5C6=C7c8c4c4C2=C2[C@H]9[C@H]%10c4c-4c8[C@@H]8[C@@H]%11c%12c-4c%10c4c%10c9c9c2c2c%13c%14c(c5c5c6c6c%15c%16c(c%11c%11c%12c4c4c%10c%10c9c%13c9c%12c%14c5c%15c%12c5c%16c%11c4c5c%109)[C@]64C[N+](C)(C)C[C@@]784)[C@@]32C1 |wU:67.94,19.22,14.15,20.50,wD:4.13,6.6,68.99,61.86,5.10,15.28,c:7,t:14,(-4.73,2.21,;-3.99,2.94,;-4.27,3.96,;-2.71,3.74,;-1.44,2.42,;.39,2.73,;1.52,1.26,;2.96,.81,;3.34,1.72,;2.33,3.05,;.89,3.55,;-.61,3.89,;-1.99,3.21,;-3.43,2.65,;-3.6,2.78,;-2.09,3.53,;-.61,4.01,;.81,3.53,;2.34,3.18,;3.6,1.9,;3.09,.92,;1.42,1.35,;.37,2.62,;-1.4,2.49,;-2.13,.95,;-3.48,.28,;-4.21,1.1,;-4.56,.17,;-4.1,1.07,;-3.48,.2,;-3.33,-1.54,;-1.89,-1.97,;-1.16,-.48,;.61,-.36,;1.63,-1.65,;3.01,-.97,;3.65,-1.78,;2.93,-3.28,;2.95,-3.27,;3.71,-1.77,;3.17,-.95,;1.72,-1.54,;.69,-.18,;-1.08,-.38,;-1.81,-1.88,;-3.29,-1.46,;-3.76,-2.42,;-4.38,-1.6,;-3.8,-2.45,;-2.78,-3.78,;-1.3,-4.21,;-.85,-3.31,;.91,-3.15,;1.53,-3.95,;.18,-4.61,;.2,-4.6,;1.56,-3.92,;.96,-3.06,;-.79,-3.23,;-1.27,-4.17,;-2.76,-3.77,;4.16,-.86,;5.06,-1.37,;6.23,-.06,;6.99,-.8,;6.97,.68,;5.09,1.19,;4.09,.89,;-2.14,.84,;-3.45,1.35,)|
[H][C@@]12C3=c4c5c6c7c8C(=C9c%10c1c1c%11c%12-c%13c%14c%15c%16c%17c%18c(c4c4c5c5c7c7c%19c8[C@]8%20[C@@H](N(CC(O)=O)C[C@]98[C@]([H])(c%10%12)[C@]8([H])c%13c9c%10c8c%20c%19c8c%10c%10c(c%159)c%16c9c%18c4c4c9c%10c8c7c54)C(O)=O)[C@@]([H])([C@@]31[H])[C@@]%17([H])[C@@]%11%14[H])[C@@]26[H] |c:2,t:8|
[H][C@@]12C3=c4c5c6c7c8C(=C9c%10c1c1c%11c%12-c%13c%14c%15c%16c%17c%18c(c4c4c%19c%18c%18c%16c%16c%15c%15c%13[C@]%13([H])c%20c%21c%22c(c8[C@@]%218[C@@H]([C@@H](CC(O)=C)[C@@H](C(O)=O)[C@]98[C@]%13([H])c%10%12)C(O)=O)c8c7c(c7c8c8c%22c(c%15%20)c%16c8c%18c%197)c54)[C@@]([H])([C@@]31[H])[C@@]%17([H])[C@@]%11%14[H])[C@@]26[H] |c:2,t:8|
OC(=O)c1ccc2c(C3CCCCC3)c([nH]c2c1)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(C)cc1
Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(OCc2ccccc2)cc1
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CC(=O)N3CCOCC3)c2c1
CS(=O)(=O)NC(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1cccc(F)c1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(c2c1)S(=O)(=O)c1ccccc1
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CCN3CCOCC3)c2c1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(O)cc1
COc1ccc(cc1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N(C)C)C(O)=O
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(O)cc1F
OC(=O)c1ccc2c(C3CCCCC3)c([nH]c2c1)-c1ccc(O)cc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1Cl |(-.96,6.24,;.05,5.1,;1.57,5.4,;-.41,3.65,;-1.93,3.33,;.61,2.49,;.12,1.04,;1.03,-.22,;.12,-1.45,;.52,-2.95,;-.55,-4.04,;-.16,-5.51,;1.34,-5.91,;2.43,-4.81,;2.01,-3.32,;-1.34,-.99,;-2.67,-1.76,;-4,-.99,;-4,.55,;-2.67,1.32,;-1.34,.55,;-5.36,1.32,;-6.69,.55,;-5.36,2.86,;2.57,-.05,;3.2,1.34,;4.74,1.49,;5.64,.23,;5,-1.19,;3.46,-1.31,;2.83,-2.71,)|
Cc1ccc(cc1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N1CCOCC1)C(O)=O
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(Cc3ccccc3)c2c1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1cccc(Cl)c1
OC(=O)c1ccc2n(C3CCCCC3)c(cc2c1)-c1ccc(O)cc1
C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O
COc1ccccc1[C@H]1[C@H](C[C@](CC(C)C)(N1C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1cccc2ccccc12)c1cccs1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccncc1)c1cccs1)C(O)=O)C(O)=O
OC(=O)CC[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccc(C)cc1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)[N+]([O-])=O)c1cccs1)C(O)=O)C(O)=O
CCCC[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O
OC(=O)[C@H]1C[C@](Cc2ccccc2)(N([C@H]1c1ccccc1)C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1cccs1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1cccc(c1)C(F)(F)F)c1cccs1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccccc1C(F)(F)F)c1cccs1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccccc1)c1cccs1)C(O)=O)C(O)=O
CCCCCCC(=O)N1[C@H]([C@H](C[C@@]1(CC(C)C)C(O)=O)C(O)=O)c1cccs1
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(Cl)c(Cl)c1)c1cccs1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(Cl)cc1)c1cccs1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1nccs1)C(O)=O)C(O)=O
OC(=O)[C@H]1C[C@](Cc2ccc(O)cc2)(N([C@H]1c1ccccc1)C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O
OC(=O)[C@H]1C[C@H](N(C1)C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccco1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccc(Cl)cc1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1cccs1)C(O)=O)C(O)=O
OC(=O)[C@H]1C[C@H](N(C1)C(=O)c1ccc(Cl)c(Cl)c1)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccn1)C(O)=O)C(O)=O
CC(C)C[C@]1(C[C@@H]([C@H](C(C)C)N1C(=O)c1ccc(cc1)C(F)(F)F)C(O)=O)C(O)=O
NCCC[C@]1(C[C@@H]([C@@H](N1C(=O)c1ccc(cc1)C(F)(F)F)c1ccccc1)C(O)=O)C(O)=O
CCCC(CCC)Nn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:19|
CCCCNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCC2=CCOC=C2)c2ccccc12 |c:26,t:3,22|
Cc1ccc(CNn2c3ccccc3c(O)c(C3=Nc4ccccc4S(=O)(=O)N3)c2=O)cc1 |t:18|
Cc1cccc(CNn2c3ccccc3c(O)c(C3=Nc4ccccc4S(=O)(=O)N3)c2=O)c1 |t:19|
CC(C)(C)CCNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:18|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2cccnc2)c2ccccc12 |t:3|
CC(C)COn1c2ncccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
Cc1ccsc1CNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:20|
Cc1ccccc1CNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:21|
CC(C)Nn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2ccccc2Br)c2ccccc12 |t:3|
CCC(CC)Nn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2ccc(Br)cc2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCC2CC2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCC2CCCCC2)c2ccccc12 |t:3|
CC(C)CCn1c2ncccc2c(O)c(C2=NS(=O)(=O)c3ccccc3N2)c1=O |t:16|
CC(C)CCNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2cccs2)c2ccccc12 |t:3|
Oc1c(C2=NS(=O)(=O)c3ccccc3N2)c(=O)n(C2CCCCC2)c2ncccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2ccoc2)c2ccccc12 |t:3|
CC(C)CNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NC2CCCCC2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2nccs2)c2ccccc12 |t:3|
CCCC(CC)Nn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:18|
CC(Nn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)c1ccccc1 |t:14|
CCCCCNn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCC2CCCC2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2ccco2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2ccccc2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2ccc(Cl)s2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCC2CCC2)c2ccccc12 |t:3|
Oc1c(C2=NS(=O)(=O)c3ccccc3N2)c(=O)n(Cc2ccccc2)c2ncccc12 |t:3|
CCCC(Nn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)C(C)C |t:16|
CCC(CC)Cn1c2ncccc2c(O)c(C2=NS(=O)(=O)c3ccccc3N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCc2cccc(Br)c2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(NCC2CCCCCC2)c2ccccc12 |t:3|
Oc1c(C2=NS(=O)(=O)c3ccccc3N2)c(=O)n(CC2CCCCC2)c2ncccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(OCc2ccccc2)c2ncccc12 |t:3|
CCC(CC)n1c2ncccc2c(O)c(C2=NS(=O)(=O)c3ccccc3N2)c1=O |t:16|
CC(Sn1c2ncccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)c1ccccc1 |t:14|
Oc1c(C2=NS(=O)(=O)c3ccccc3N2)c(=O)n(CCc2ccccc2)c2ncccc12 |t:3|
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2c(F)cccc2Br)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2c(Cl)cccc2[N+]([O-])=O)cc1
OCc1ccc(cc1)-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2c(F)cccc2Cl)cc1
CSc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
Cc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1cccc(c1)[N+]([O-])=O
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccccc1OC(F)(F)F
COc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1cccc(F)c1
CSc1ccc(cc1)-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccc(Cl)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccccc1F
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccc(OC(F)(F)F)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ncc(s1)-c1ccccc1Cl
NS(=O)(=O)c1cccc(c1)-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(s1)-c1ccccc1Cl
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2)cc1
Cc1cccc(Cl)c1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
CCc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccccc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1cccc(n1)-c1ccccc1Cl
OCc1ccccc1-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)s1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccc(cc1)C(F)(F)F
c1ccc(cc1)C(=O)N/C(=C\c2ccc(cc2)Oc3ccccc3Br)/C(=O)O
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(s1)-c1ccccc1F
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1cccc(OC(F)(F)F)c1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccccc1Cl
COc1ccccc1-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2-c2ccccc2)cc1
Nc1cccc(Cl)c1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccccc1[N+]([O-])=O
NS(=O)(=O)c1ccc(cc1)-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2C#N)cc1
CC(C)(C)c1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1cccc(Cl)c1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2I)cc1
Cc1ccccc1-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)s1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(s1)-c1ccccc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1cncc(c1)-c1ccccc1Cl
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2[N+]([O-])=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccc(F)cc1
CC(C)c1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
Cc1ccccc1-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
CC(C)Oc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Cl)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2C(F)(F)F)cc1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1cccc(c1)C(F)(F)F
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(o1)-c1ccccc1C(F)(F)F
OC(=O)C(\NC(=O)c1ccccc1)=C\c1cccc(c1)-c1ccccc1Cl
OCc1cccc(c1)-c1ccc(\C=C(/NC(=O)c2ccccc2)C(O)=O)o1
OC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2F)cc1
OC(=O)C(\NC(=O)C1CC2CCC1C2)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CCC1CCCC1)=C\c1ccc(Oc2ccc(F)cc2Br)cc1
Brc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)NCc2ccccc2)cc1
OC(=O)C(\NC(=O)CCc1ccc(Cl)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
Oc1cccc(NC(=O)C(\NC(=O)c2ccccc2)=C\c2ccc(Oc3ccccc3Br)cc2)c1
OC(=O)C(\NC(=O)C1CC1)=C\c1ccc(Oc2ccccc2I)cc1
OC(=O)C(\NC(=O)Cc1ccc(Cl)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
Cc1ccc(cc1)C(=O)N\C(=C/c1ccc(Oc2ccccc2Br)cc1)C(O)=O
Oc1ccccc1NC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)CCCC(=O)N\C(=C/c1ccc(Oc2ccccc2I)cc1)C(O)=O
OC(=O)C(\NC(=O)c1ccc(Br)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
CCc1ccccc1Oc1ccc(\C=C(/NC(=O)CCC2CCCC2)C(O)=O)cc1
CC(O)C(=O)N\C(=C/c1ccc(Oc2ccccc2I)cc1)C(O)=O
OC(=O)C(\NC(=O)c1ccccc1F)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)CNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CCC1CCCCC1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)Cc1ccc(cc1)C(F)(F)F)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CCc1ccc(cc1)C(F)(F)F)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)c1ccc(F)cc1F)=C\c1ccc(Oc2ccccc2Br)cc1
CCc1ccccc1C(=O)N\C(=C/c1ccc(Oc2ccccc2Br)cc1)C(O)=O
OC(=O)C(\NC(=O)c1ccc(Cl)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CCC1CCCC1)=C\c1ccc(Oc2ccccc2I)cc1
OC(=O)C(\NC(=O)c1ccccc1O)=C\c1ccc(Oc2ccccc2Br)cc1
NC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
CONC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
Brc1ccccc1Oc1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)Nc2ccccc2)cc1
Cc1ccc(CCC(=O)N\C(=C/c2ccc(Oc3ccccc3Br)cc2)C(O)=O)cc1
OC(=O)C(\NC(=O)Cc1ccc(Br)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
NNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CCC1CCCC1)=C\c1ccc(Oc2ccccc2Br)cc1
Oc1ccc(NC(=O)C(\NC(=O)c2ccccc2)=C\c2ccc(Oc3ccccc3Br)cc2)cc1
OC(=O)C(\NC(=O)CCc1ccc(F)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)c1ccccc1NC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(C(=O)N\C(=C/c1ccc(Oc2ccccc2I)cc1)C(O)=O)c1ccccc1
OC(=O)C(\NC(=O)C12CC3CC(CC(C3)C1)C2)=C\c1ccc(Oc2ccccc2Br)cc1 |TLB:14:9:16:15.13.12,14:13:16:8.9.10,THB:12:13:8:16.11.10,12:11:8:15.13.14|
Nc1ccc(Oc2ccc(\C=C(/NC(=O)CCC3CCCC3)C(O)=O)cc2)c(c1)C(F)(F)F
OCCNC(=O)C(\NC(=O)c1ccccc1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CC1CCCCC1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)C1CCCCC1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)Cc1ccc(F)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
OCC(=O)N\C(=C/c1ccc(Oc2ccccc2I)cc1)C(O)=O
OC(=O)CCC(=O)N\C(=C/c1ccc(Oc2ccccc2I)cc1)C(O)=O
OC(=O)C(\NC(=O)c1ccc(F)c(F)c1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)c1cccc(F)c1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CC1CCCC1)=C\c1ccc(Oc2ccccc2Br)cc1
OC(=O)C(\NC(=O)CCC1CCCC1)=C\c1ccc(Oc2ccccc2C(F)(F)F)cc1
OC(=O)C(\NC(=O)Cc1ccc(I)cc1)=C\c1ccc(Oc2ccccc2Br)cc1
COc1ccc(cc1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N1CCC(CC1)N(C)C)C(O)=O
CCN(CC)CC1CN(CCO1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(OC)cc1
CN(CC1CCCN(C)C1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C(=O)CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
CN(C)C(=O)CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CC(C)N(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CC(=O)N3CCS(=O)(=O)CC3)c2c1
CN(C)C1CCN(CC1)C(=O)Cn1c(C=C)c(C2CCCCC2)c2ccc(cc12)C(O)=O
CN(C)Cc1ccc(cc1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N(C)C)C(O)=O
CN(C)C1CNC(C1)C(=O)Cn1c(c(C2CCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C1CNC(C1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1cccnc1
CN(C)Cc1cc(ccc1Cl)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N(C)C)C(O)=O
CN(C)C1CCN(CC1)C(=O)Cn1c(C2CCCCC2)c(C2CCCCC2)c2ccc(cc12)C(O)=O
CN1CCN(CC1)C(=O)Cn1c(c(C2CCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CCc1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N1CCC(CC1)N(C)C)C(O)=O
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1cccc(CN2CCCC(F)(F)C2)c1
CS(=O)(=O)N1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CC(C)N(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
CN(C)C(=O)Cn1c(-c2ccoc2)c(C2CCCCC2)c2ccc(cc12)C(O)=O
CCN(CC)C1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
CN(CC1CCCN(C)C1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
COc1ccc(cn1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N(C)C)C(O)=O
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccc(Cl)cc3)n(CC(=O)NCC3CC3)c2c1
CN1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2cc(ccc12)C(O)=O)-c1ccccc1
CN(C)C1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)C1=CCCCC1 |t:34|
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccc(Cl)cc3)n(CC(=O)N3CCS(=O)(=O)CC3)c2c1
CC(C)N(C)Cc1cccc(c1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N(C)C)C(O)=O
CCN(CC)C1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(OC)cc1
CN(C)C1CCN(CC1)C(=O)Cn1c(C#C)c(C2CCCCC2)c2ccc(cc12)C(O)=O
CN(CC1CCCN(C)C1)C(=O)Cn1c(c(C2CCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccncc1
CN1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
CN(C)Cc1cccc(c1)-c1c(C2CCCCC2)c2ccc(cc2n1CC(=O)N(C)C)C(O)=O
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccoc3)n(CC(=O)N3CCC(CC3)N3CCC3)c2c1
CN(C)C1CNC(C1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
OC(=O)c1ccc2c(C3CCCCC3)c(-c3ccccc3)n(CC(=O)NCC3CC3)c2c1
CN1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccc1
CS(=O)(=O)N1CCN(CC1)C(=O)Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(Cl)cc1
CN(C)C1CNC(C1)C(=O)Cn1c(c(C2CCCCC2)c2cc(ccc12)C(O)=O)-c1ccccc1
OC(=O)C(=O)CC(=O)c1cnc2cc(Cl)ccc2c1O
OC(=O)C(=O)CC(=O)c1cc(O)cc(OCc2c(Cl)cccc2C#N)c1
OC(=O)C(=O)CC(=O)c1ccsc1Cc1ccc(F)cc1
OC(=O)C(=O)CC(=O)c1cc(O)ccc1OCCCC#N
Cc1cc(C(=O)CC(=O)C(O)=O)c(C)o1
OC(=O)C(=O)CC(=O)c1ccc(Cc2ccc(F)cc2)s1
OC(=O)C(=O)CC(=O)c1cccc(Cc2cc(Br)cc(Br)c2)c1
OC(=O)C(=O)CC(=O)c1ccn(Cc2cccc(c2)C#N)c1
COc1cccc(c1)C(=O)CC(=O)C(O)=O
Cc1ccc(Cn2cccc2C=CC(=O)CC(=O)C(O)=O)cc1 |w:12.13|
OC(=O)C(=O)CC(=O)c1cccc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c1
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(F)cc1
OC(=O)C(=O)CC(=O)c1ccc(Cc2ccccc2)s1
OC(=O)C(=O)CC(=O)c1cc(I)cn1Cc1ccc(F)cc1
OC(=O)C(=O)CC(=O)c1cccc(OCc2cccc3ccccc23)c1
CCCCS(=O)(=O)N1CCCC(Cc2ccc(Cl)cc2)(C1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccccc1C#N
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccc(cc2)-c2ccccc2)c1
OC(=O)C(=O)CC(=O)c1ccsc1Sc1cccc(Cl)c1
OC(=O)C(=O)CC(=O)c1ccc(Cc2cccc(Cl)c2)s1
OC(=O)C(=O)CC(=O)c1cccc(O)c1
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccsc2C(O)=O)c1
Cc1sc(cc1C(=O)CC(=O)C(O)=O)-c1ccccc1
OC(=O)C(=O)CC(=O)c1cccc(Oc2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cccn1Cc1c(F)cccc1F
Cn1cc(cc1Cc1cccc(F)c1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccc(OCc2cccc(Oc3ccccc3)c2)c1
Cc1ccc(o1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cc(O)cc(OCc2ccccc2)c1
OC(=O)C(=O)CC(=O)C=Cc1cccn1Cc1cccc(F)c1 |w:8.7|
OC(=O)C(=O)CC(=O)c1cc2COc3ccc(F)cc3-c2s1
OC(=O)C(=O)CC(=O)c1ccsc1Cc1cccc(F)c1
OC(=O)C(=O)CC(=O)c1cccc(c1)-c1ccccc1
OC(=O)C(=O)CC(=O)c1ccccc1Cc1ccc(F)cc1
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccccc1Cl
OC(=O)C(=O)CC(=O)c1ccc(Cc2cccc(F)c2)s1
COc1cccc(Cn2cccc2C(=O)CC(=O)C(O)=O)c1
Cc1cc(C)c(s1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1ccc(s1)N1CCCCC1
Cc1ccc(C(=O)CC(=O)C(O)=O)c(C)c1
OC(=O)C(=O)CC(=O)c1cccc(OCc2cc(on2)-c2ccccc2)c1
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc(O)cc1
OC(=O)C(=O)CC(=O)c1cccc(NS(=O)(=O)c2cc(Cl)c(Cl)cc2Cl)c1
OC(=O)C(=O)CC(=O)c1cccn1CCCCC#N
OC(=O)C(=O)CC(=O)c1ccc(o1)-c1ccc(F)c(Cl)c1
OC(=O)C(=O)CC(=O)c1cccc(c1)N1CCCC1
OC(=O)C(=O)CC(=O)c1cccn1Cc1cccc(F)c1
Cn1cc(cc1C=CC(=O)CC(=O)C(O)=O)C(=O)c1ccc(F)cc1 |w:7.8|
OC(=O)C(=O)CC(=O)c1cccc(OCc2cc(Cl)c(Cl)cc2C#N)c1
COc1ccc(Cn2cccc2C=CC(=O)CC(=O)C(O)=O)cc1 |w:13.14|
OC(=O)C(=O)CC(=O)c1cccc(NC(=O)C(O)=O)c1
OC(=O)C(=O)CC(=O)c1sccc1Cc1cccc(F)c1
OC(=O)C(=O)CC(=O)C12C[C@H]3C[C@H](C[C@H](C3)C1)C2 |THB:13:12:9:16.14.15,13:14:9:17.12.11|
Cc1cccc(c1)C(=O)CC(=O)C(O)=O
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccc2ccccc2c1
OC(=O)C(=O)CC(=O)C=Cc1c[nH]c2ccc(Cl)cc12 |w:8.7|
OC(=O)C(=O)CC(=O)c1cccn1Cc1ccccc1
Cc1coc(C)c1C(=O)CC(=O)C(O)=O
Cc1ccccc1Cn1cccc1C=CC(=O)CC(=O)C(O)=O |w:14.16|
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccc2C)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(F)cc2)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCCCCC2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(cc2)C#N)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCCCC2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2cccc(C)c2)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccc2)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccc2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccc2OC(F)(F)F)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)sc2CC(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(F)cc2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccnn2C)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCOCC2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccc2C(F)(F)F)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCc3ccccc3C2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCCC2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2nccn2C)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(C)(=O)=O)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCc3ccccc23)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCN(CC2)C(C)=O)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccccn2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)N2CCN(C)CC2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ncccn2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cn2)sc2CC(C)(C)CCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2cccc(OC)c2)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2cccc3ccccc23)sc2CCCCc12
CCCCS(=O)(=O)NC(=O)Nc1sc2CCCCc2c1C(=O)OCC
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)sc2CCCC(C)c12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)sc2CCCCc12
CCOC(=O)c1c(NC(=O)c2nccnc2C(O)=O)sc2CCCCc12
CCOC(=O)c1c(NC(=O)NS(=O)(=O)c2ccc(C)cc2)sc2CCC(C)Cc12
CCC[C@]1(CC(O)=O)OCCc2c1sc1c(C)ccc(C#N)c21
CCCC1(CC(O)=O)OCCc2c1sc1c(Cl)ccc(Cl)c21
CCC1(CC(O)=O)OCCc2c1sc1c(Cl)ccc(Cl)c21
CCCC1(CC(O)=O)OCCc2c1oc1c(Cl)ccc(Cl)c21
CC1(CC(O)=O)OCCc2c1sc1c(Cl)ccc(Cl)c21
CCCCC1(CC(O)=O)OCCc2c1sc1c(Cl)ccc(Cl)c21
CCC[C@]1(CC(O)=O)OCCc2c1sc1c(C)cc(F)c(C#N)c21
CCCC1(CC(O)=O)OCCc2c1sc1ccccc21
CCCC1(CC(O)=O)OCCc2c1sc1c(C)cc(F)c(C#N)c21
CCC[C@@]1(CC(O)=O)OCCc2c1sc1c(C)ccc(C#N)c21
CCC[C@@]1(CC(O)=O)OCCc2c1sc1c(C)cc(F)c(C#N)c21
CCC1(CC(O)=O)OCCc2c1oc1c(Cl)ccc(Cl)c21
CC1(CC(O)=O)OCCc2c1oc1c(Cl)ccc(Cl)c21
CCCC1(CC(O)=O)OCCc2c1oc1ccccc21
CCCCC1(CC(O)=O)OCCc2c1oc1c(Cl)ccc(Cl)c21
CCCC1(CC(O)=O)OCCc2c1sc1c(C)ccc(C#N)c21
CCCC1(CC(O)=O)OCCc2c1sc1c(C)ccc(Br)c21
CCCC1(CC(O)=O)OCCc2c1sc1c(C)cc(F)cc21
CC(C)CCn1c2ccc(OCC#N)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:20|
Oc1c(-c2nc3ccccc3c(=O)[nH]2)c(=O)n(CCC2CC2)c2ccc(F)cc12
CCCCn1c2ccccc2c(O)c(-c2nc3ccccc3[nH]2)c1=O
CC(C)(C)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CCOC(=O)c1ccc2c(O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(=O)n(CCC(C)C)c2c1 |t:12|
CC(C)CCn1c2c(cccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)[N+]([O-])=O |t:16|
CC(C)CCn1c2ccc(Cl)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)CCn1c2ccc(F)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)Cn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
CC(C)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCCC(F)(F)F)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)[nH]c2ccccc12 |t:3|
Nc1ccc2n(CCC3CC3)c(=O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(O)c2c1 |t:15|
CC(C)CCn1c2cc(C=CC(N)=O)ccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |w:9.8,t:21|
CC(C)CCn1c2ccccc2c(O)c(C2=NS(=O)(=O)c3ccccc3N2C)c1=O |t:16|
CC(CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)C(F)(F)F |t:15|
OCCCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC2CCCC2)c2ccccc12 |t:3|
CC(C)CCn1c2ccc(I)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC2CCC2)c2ccccc12 |t:3|
CC(C)CCn1c2cccc(O)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2cccc(Br)c2)c2ccccc12 |t:3|
CN(C)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCc2ccsc2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCN2CCCC2)c2ccccc12 |t:3|
COC(C)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC2CCCO2)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCCC#C)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccccn2)c2ccccc12 |t:3|
CC(C)CCn1c2cc(Br)ccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)CCn1c2ccc(OCc3ccccc3)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:25|
NCCCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
CCOC(=O)CNc1ccc2n(CCC(C)C)c(=O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(O)c2c1 |t:20|
CC(C)CCn1c2cccc(-c3ccccc3)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:23|
CC(C)CCn1c2cccc(C)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2cccnc2)c2ccccc12 |t:3|
CS(=O)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
CSCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
CC(C)CCn1c2ccc(cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)[N+]([O-])=O |t:16|
COc1ccc2n(CCC(C)C)c(=O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(O)c2c1 |t:15|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC2CCOC2)c2ccccc12 |t:3|
CCOC(=O)c1ccc2n(CCC(C)C)c(=O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(O)c2c1 |t:18|
[#6]\[#6](-[#6])=[#6]\[#6]-n1c2ccccc2c(-[#8])c(-[#6]-2=[#7]-c3ccccc3S(=O)(=O)[#7]-2)c1=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccccc2[N+]([O-])=O)c2ccccc12 |t:3|
CCCCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ccccc2c(=O)n(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
COCCOc1ccc2n(CCC(C)C)c(=O)c(C3=Nc4ccccc4S(=O)(=O)N3)c(O)c2c1 |t:18|
CCC(C)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CS(=O)(=O)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
c1ccc2c(c1)N=C(NS2(=O)=O)C3=C(c4cc(ccc4N(C3=O)CCC5CC5)F)O
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC2CC2)c2ccccc12 |t:3|
CC(C)(C)CCn1c2ccc(NCCO)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:21|
CC(C)CCn1c2ccc(OCC(N)=O)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:21|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccc(cc2)[N+]([O-])=O)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2cccc(c2)[N+]([O-])=O)c2ccccc12 |t:3|
OCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:14|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCC2CC2)c2ccccc12 |t:3|
OCCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCC#C)c2ccccc12 |t:3|
CC1CC1Cn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)(C)c1ccc(Cn2c3ccccc3c(O)c(C3=Nc4ccccc4S(=O)(=O)N3)c2=O)cc1 |t:20|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCCc2ccccc2)c2ccccc12 |t:3|
CC(C)CCn1c2ccc(NC(=O)c3ccccc3)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:26|
CC(C)CCn1c2ccc(NC(=O)CC(C)C)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:23|
CC(C)CCn1c2ccc(NC(=O)C3CCCC3)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:25|
CC(C)CCn1c2ccc(C)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCc2ccccc2)c2ccccc12 |t:3|
CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:13|
CC(C)CCn1c2cccc(F)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
NC(=O)CCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:14|
CC(C)CCn1c2cc(F)ccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)CCn1c2ccc(NC(=O)CN(C)C)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:23|
Cn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:12|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCC2CC2)c2c(F)cccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCC=C)c2ccccc12 |t:3|
CC(C)CCn1c2cc(ccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)C(O)=O |t:16|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC2CCCCC2)c2ccccc12 |t:3|
CC(Br)CCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ccc(NC(C)=O)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:20|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccncc2)c2ccccc12 |t:3|
CN(C)C(=O)Cn1c2ccc(F)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:18|
OC(=O)CCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)CCn1c2cccc(Cl)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CC=C)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccc(Br)cc2)c2ccccc12 |t:3|
Cc1nc(Cn2c3ccccc3c(O)c(C3=Nc4ccccc4S(=O)(=O)N3)c2=O)cs1 |t:16|
COCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
CC(C)CCn1c2cc(Cl)ccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCCCC#N)c2ccccc12 |t:3|
CC(C)CCn1c2ccc(NCC(O)=O)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:21|
CC(C)CCn1c2cccc(Br)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCCC#N)c2ccccc12 |t:3|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(CCc2cccs2)c2ccccc12 |t:3|
CC(C)(C)C(=O)Cn1c2ccc(F)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:19|
CC(C)CCn1c2ccc(cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)C(O)=O |t:16|
CC(C)CCn1c2ccc(N)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CC(C)CCn1c2cccc([N+]([O-])=O)c2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:19|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccoc2)c2ccccc12 |t:3|
CCOC(=O)n1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ccc(OCCCC#N)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:22|
CC(C)CCn1c2ccc(O)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
CCOC(=O)CCCn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:19|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccccc2)c2ccccc12 |t:3|
CC(C)CCn1cc(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)c2ccccc12 |t:8|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(-c2ccccc2)c2ccccc12 |t:3|
CC(C)CCn1c2cc(ccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O)[N+]([O-])=O |t:16|
C\C=C\Cn1c2ccccc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
CC(C)CCn1c2ccccc2c(N)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ccccc2cc(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:15|
CC(C)CCn1c2ccc(Br)cc2c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O |t:17|
Oc1c(C2=Nc3ccccc3S(=O)(=O)N2)c(=O)n(Cc2ccccc2C#N)c2ccccc12 |t:3|
OC1N(NS(=O)(=O)c2ccc(F)cc2)C(=S)S\C1=C/c1ccc(Cl)c(Cl)c1
Brc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:5.4|
Fc1ccc(F)c(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)c1 |w:7.6|
O=C1N(NS(=O)(=O)c2ccccc2)C(=S)SC1=Cc1ccc2OCOc2c1 |w:17.19|
CN1C(=S)S\C(=C/c2ccc(Cl)cc2)C1=O
O=C1N(NS(=O)(=O)c2ccccc2)C(=S)SC1=Cc1ccccc1 |w:17.19|
O=C1N(NS(=O)(=O)c2ccccc2)C(=S)SC1=Cc1cccnc1 |w:17.19|
Cc1ccc(\C=C2/SC(=S)N(N)C2=O)cc1
NN1C(=S)S\C(=C/c2ccccc2)C1=O
NN1C(=S)S\C(=C/c2ccc(Cl)cc2)C1=O
NN1C(=S)S\C(=C/c2ccc(cc2)C#N)C1=O
CC(C=C1SC(=S)N(NS(=O)(=O)c2ccccc2)C1=O)=Cc1ccccc1 |w:2.1,20.22|
OC1C(Cc2ccc(Cl)c(Cl)c2)SC(=S)N1NS(=O)(=O)c1ccccc1
Clc1ccc(\C=C2/SC(=S)N(Cc3ccccc3)C2=O)cc1
Cc1cccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)c1 |w:6.5|
CN1C(=S)S\C(=C/c2ccc(cc2)[N+]([O-])=O)C1=O
O=C1N(NS(=O)(=O)c2ccccc2)C(=S)SC1=Cc1ccc2ccccc2c1 |w:17.19|
COc1cccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)c1 |w:7.6|
Brc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1Br |w:5.4|
Cc1ccc(cc1)S(=O)(=O)NN1C(O)\C(SC1=S)=C\c1ccc(Cl)c(Cl)c1
Cc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:5.4|
Fc1cc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)ccc1Cl |w:4.3|
FC(F)(F)c1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:8.7|
CCN1C(=S)S\C(=C/c2ccc(Cl)cc2)C1=O
Cc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1C |w:5.4|
Clc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3cccs3)C2=O)cc1Cl |w:5.4|
Fc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)c(F)c1F |w:5.4|
Fc1cc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc(F)c1F |w:4.3|
[O-][N+](=O)c1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:7.6|
OC1N(NS(=O)(=O)c2ccccc2F)C(=S)S\C1=C/c1ccc(Cl)c(Cl)c1
O=C1N(NS(=O)(=O)c2ccccc2)C(=S)SC1=Cc1ccc(cc1)C#N |w:17.19|
COc1cccc(c1)S(=O)(=O)NN1C(O)\C(SC1=S)=C\c1ccc(Cl)c(Cl)c1
CN(C)c1ccc(\C=C2/SC(=S)N(N)C2=O)cc1
NN1C(=S)S\C(=C/c2ccc(F)cc2)C1=O
[O-][N+](=O)c1ccc(C=C2SC(S)=NC2=O)cc1 |w:7.6,c:11|
CCCCS(=O)(=O)NN1C(=S)SC(=Cc2ccc(Cl)c(Cl)c2)C1=O |w:13.13|
Oc1c(sc(=S)n1NS(=O)(=O)c1ccccc1)C(=C)c1ccc(Cl)c(Cl)c1
COc1ccc(\C=C2/SC(=S)N(N)C2=O)cc1
COc1ccc(cc1)S(=O)(=O)NN1C(O)\C(SC1=S)=C\c1ccc(Cl)c(Cl)c1
FC(F)(F)c1ccc(Cl)c(c1)-c1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)o1 |w:15.15|
OC1N(NS(=O)(=O)c2ccc(Cl)cc2)C(=S)S\C1=C/c1ccc(Cl)c(Cl)c1
NN1C(=S)S\C(=C/c2ccc(cc2)[N+]([O-])=O)C1=O
Fc1cc(F)c(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1F |w:6.5|
COc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:6.5|
Fc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:5.4|
SC1=NC(=O)C(S1)=Cc1ccc(Cl)cc1 |w:7.8,t:1|
Oc1c(Cc2ccc(Cl)c(Cl)c2)sc(=S)n1NS(=O)(=O)c1ccccc1
Fc1ccccc1C=C1SC(=S)N(NS(=O)(=O)c2ccccc2)C1=O |w:7.7|
Clc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)cc1 |w:5.4|
CS(=O)(=O)NN1C(=S)SC(=Cc2ccc(Cl)c(Cl)c2)C1=O |w:10.10|
Fc1ccc(C=C2SC(=S)N(NS(=O)(=O)c3ccccc3)C2=O)c(F)c1 |w:5.4|
Clc1ccc(C=C2SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1 |w:5.4|
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2-c2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccc(F)cc2)c2ccc(F)cc2)cc1F
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2cc(Cl)cc(Cl)c2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCCc2ccccc2-c2ccccc2)cc1
COc1ccc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCC2)C(O)=O)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccc(F)cc2)c2ccc(F)cc2)cc1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2ccccc2)cc1
CC(C)(C)c1ccc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCC2)C(O)=O)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(Oc2ccccc2-c2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCC(c2ccccc2)c2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2cccnc2)c2cccnc2)cc1F
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCCOc2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCCCCCc2ccccc2)cc1
Cc1ccc(cc1)C(Oc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O)c1ccc(C)cc1
Cc1ccc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCC2)C(O)=O)cc1
OC(=O)c1ccc2n(C3CCCCCC3)c(nc2c1)-c1ccc(OCc2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccccc2)c2ccccc2)cc1F
OC(=O)c1ccc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCC2)C(O)=O)cc1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccccc2)c2cccnc2)cc1F
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccccc2)c2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2ccc(Cl)cc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCc2cccc(c2)-c2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OCCCc2ccccc2)cc1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2ccncc2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2cccc(F)c2)c2cccc(F)c2)cc1
CN(C)C(=O)c1ccc(cc1)C(Oc1ccc(-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(F)c1)c1ccc(cc1)C(=O)N(C)C
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2cccc(Cl)c2)cc1
OC(=O)c1ccc2n(C3CCCCC3)c(nc2c1)-c1ccc(OC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccc(OCc2ccccc2Cl)cc1
CC(C)(C)CCN1[C@H](C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1)c1ccc(F)cc1 |t:14|
CCC(C)[C@@H]1N(Cc2ccccc2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:20|
CC(C)CCN1[C@@H](Cc2ccccc2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:21|
CC(C)CCN1[C@H](C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1)C(C)(C)C |t:13|
CC(C)(C)CCN1[C@H](C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1)C(C)(C)C |t:14|
CC(C)(C)[C@@H]1N(CCC2CC2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:18|
CC(C)CCN1[C@@H](C(C)C)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:16|
CC(C)(C)CCN1[C@@H](C2CCCCC2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:21|
CC(C)(C)[C@@H]1N(Cc2ccccc2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:20|
CC(C)(C)[C@@H]1N(Cc2ccccn2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:20|
Fc1ccc(CN2[C@@H](Cc3cccnc3)C(=O)C(C2=O)C2=Nc3ccccc3S(=O)(=O)N2)cc1 |t:22|
CC(C)(C)[C@@H]1N(Cc2ccc(F)cc2)C(=O)C(C1=O)C1=Nc2ccccc2S(=O)(=O)N1 |t:21|
Cc1ccc(C#N)c2c3CCC(CC=C)(C(O)=O)c3[nH]c12
CCCCC1(CCc2c1[nH]c1c(F)ccc(C#N)c21)C(O)=O
CCCC1(CCc2c1[nH]c1c(F)ccc(C#N)c21)C(O)=O
CCCCC1(CCc2c1[nH]c1c(C)cc(F)c(C#N)c21)C(O)=O
Cc1cc(F)c(C#N)c2c3CCC(CC=C)(C(O)=O)c3[nH]c12
OC(=O)C1(CC=C)CCc2c1[nH]c1c(F)ccc(C#N)c21
CCCC1(CC(O)=O)CCCc2c1[nH]c1cc(F)cc(F)c21
CCCCC1(CCc2c1[nH]c1c(C)ccc(C#N)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1ccc(Cl)cc21
CCCC1(CCc2c1[nH]c1c(C)cc(F)c(C#N)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(ccc(C#N)c21)C#N
CCCCC1(CCc2c1[nH]c1c(Cl)ccc(Cl)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(ccc(C#N)c21)C(N)=O
CCCC1(CCCc2c1[nH]c1c(F)ccc(C#N)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(F)ccc(C#N)c21
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(F)c(F)ccc21
CCCC1(CCCc2c1[nH]c1c(C)ccc(C#N)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(Cl)cc(Br)cc21
CCCC1(CCc2c1[nH]c1c(Cl)ccc(Cl)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(F)ccc(F)c21
CCCC1(CC(O)=O)CCCc2c1[nH]c1ccccc21
OC(=O)C1(CC=C)CCc2c1[nH]c1c(Cl)ccc(Cl)c21
CCCC1(CCCc2c1[nH]c1c(Cl)ccc(c21)C(F)(F)F)C(O)=O
CCCC1(CCc2c1[nH]c1c(C)ccc(C#N)c21)C(O)=O
CCCC1(CC(O)=O)CCCc2c1[nH]c1c(C)ccc(C#N)c21
CCCC1(CC(O)=O)OCCc2c1[nH]c1c(C)ccc(C#N)c21
CCCC1(CCCc2c1[nH]c1c(Cl)ccc(Cl)c21)C(O)=O
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)NCCc1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1cc2ccccc2s1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)NCc1ccccc1Cl
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)Cc1ccccc1Cl
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NS(=O)(=O)c1ccc2ccccc2c1
OC(=O)c1nc(-c2sccc2[N+]([O-])=O)n(Cc2ccccc2)c(=O)c1O
Cn1c(nc(C(O)=O)c(O)c1=O)-c1sccc1NC(=O)Nc1ccccc1Cl
OC(=O)c1nc([nH]c(=O)c1O)-c1cc(NC(=O)c2cccs2)cs1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)OCCc1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)CCc1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)Nc1ccccc1
OC(=O)c1nc(Cc2ccccc2)[nH]c(=O)c1O
Cn1c(nc(C(O)=O)c(O)c1=O)-c1sccc1[N+]([O-])=O
OC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1
OC(=O)c1nc([nH]c(=O)c1O)-c1ccco1
Nc1ccsc1-c1nc(C(O)=O)c(O)c(=O)[nH]1
OC(=O)c1nc([nH]c(=O)c1O)-c1nccs1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)Cc1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1[N+]([O-])=O
OC(=O)c1nc([nH]c(=O)c1O)C1CCCCC1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)Cc1c[nH]c2ccccc12
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)OCc1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)NCc1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)OCc1ccccc1Cl
Cc1ccc(s1)-c1nc(C(O)=O)c(O)c(=O)[nH]1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)Cc1csc2ccccc12
OC(=O)c1nc([nH]c(=O)c1O)-c1cc(cs1)[N+]([O-])=O
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)NCc1csc2ccccc12
OC(=O)c1nc([nH]c(=O)c1O)-c1ccc(s1)[N+]([O-])=O
CS(=O)(=O)c1nc(C(O)=O)c(O)c(=O)[nH]1
Cc1ccsc1-c1nc(C(O)=O)c(O)c(=O)[nH]1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)c1ccccc1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)OCc1cccc2ccccc12
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)Cc1c([nH]c2ccccc12)-c1ccccc1
Cc1cccc(Cl)c1CNC(=O)Nc1ccsc1-c1nc(C(O)=O)c(O)c(=O)[nH]1
OC(=O)c1nc(-c2sccc2[N+]([O-])=O)n(CC=C)c(=O)c1O
CCCCc1nc(C(O)=O)c(O)c(=O)[nH]1
OC(=O)c1nc([nH]c(=O)c1O)-c1sccc1NC(=O)OCc1c(Cl)cccc1Cl
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NN4CCC4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(N)(=O)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NCCN)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCC#C)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NCc4cccc(c4)[N+]([O-])=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCCN)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NCc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
COc1ccc(CNS(=O)(=O)Nc2ccc3N=C(NS(=O)(=O)c3c2)c2c(O)c3cccnc3n(CCC(C)C)c2=O)cc1 |c:16|
COc1cccc(CNS(=O)(=O)Nc2ccc3N=C(NS(=O)(=O)c3c2)c2c(O)c3cccnc3n(CCC(C)C)c2=O)c1 |c:17|
COc1ccccc1CNS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:19|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NCCc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
NS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2ccccc2n(NC2CCC2)c1=O |c:9|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCCCl)cc3S(=O)(=O)N2)c1=O |t:16|
CCOC(=O)c1cccc(NS(=O)(=O)Nc2ccc3N=C(NS(=O)(=O)c3c2)c2c(O)c3cccnc3n(CCC(C)C)c2=O)c1 |c:19|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCCC#N)cc3S(=O)(=O)N2)c1=O |t:16|
CNC(=O)c1ccc(NS(=O)(=O)Nc2ccc3N=C(NS(=O)(=O)c3c2)c2c(O)c3cccnc3n(CCC(C)C)c2=O)cc1 |c:17|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC4CCCC4)cc3S(=O)(=O)N2)c1=O |t:16|
COC(=O)NS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:13|
COC(=O)c1ccccc1NS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:20|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)Nc4cccc(c4)C(N)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NCCO)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(C)(=O)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCC=C)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)Nc4cccc(c4)C(=O)NCC(N)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)Nc4ccc(cc4)C(O)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NN4CCCC4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCC(O)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NN4CCCCC4)cc3S(=O)(=O)N2)c1=O |t:16|
COCCOC(=O)NS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:16|
COC(=O)c1ccc(NS(=O)(=O)Nc2ccc3N=C(NS(=O)(=O)c3c2)c2c(O)c3cccnc3n(CCC(C)C)c2=O)cc1 |c:17|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCCOCc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)N(C)C(=O)OCc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC4CCCCC4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)Nc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC(=O)OCc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NC4CCNCC4)cc3S(=O)(=O)N2)c1=O |t:16|
CNS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2ccccc2n(NC2CCC2)c1=O |c:10|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)Nc4ccc(cc4)C(N)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CCOC(=O)COC(=O)NS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:18|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)Nc4cccc(c4)C(O)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CNS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:10|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)NCCC(N)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CCCCS(=O)(=O)Nc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:12|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(O)cc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3ccc(Br)cc3S(=O)(=O)N2)c(=O)n(Cc2ccccc2)c2ncccc12 |t:3|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCC(O)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NCC#N)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NCC(N)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CCCOc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:8|
Oc1cccc2c1N=C(NS2(=O)=O)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:8|
COc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:6|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NC(=O)C(F)(F)F)cc3S(=O)(=O)N2)c1=O |t:16|
COc1cccc2c1N=C(NS2(=O)=O)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:9|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(N)cc3S(=O)(=O)N2)c1=O |t:16|
COc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:6|
COc1cccc2c1N=C(NS2(=O)=O)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:9|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCC(N)=O)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCC(=O)OC(C)(C)C)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCC#N)cc3S(=O)(=O)N2)c1=O |t:16|
Cc1cccc2c1N=C(NS2(=O)=O)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:8|
Cc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:5|
COc1ccc2c(c1)N=C(NS2(=O)=O)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:9|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCc4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)c4ccccc4)cc3S(=O)(=O)N2)c1=O |t:16|
Oc1c(C2=Nc3c(Br)cccc3S(=O)(=O)N2)c(=O)n(Cc2ccccc2)c2ncccc12 |t:3|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(NS(=O)(=O)C(C)C)cc3S(=O)(=O)N2)c1=O |t:16|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCC(=O)N(C)C)cc3S(=O)(=O)N2)c1=O |t:16|
CNC(=O)COc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c2cccnc2n(CCC(C)C)c1=O |c:10|
CC(C)CCn1c2ncccc2c(O)c(C2=Nc3ccc(OCCN)cc3S(=O)(=O)N2)c1=O |t:16|
Oc1ccc2c(c1)N=C(NS2(=O)=O)c1c(O)c2cccnc2n(Cc2ccccc2)c1=O |c:8|
COc1ccc(cc1)-c1nc2cc(ccc2n1C1CCCCC1)C(O)=O
OC(=O)c1cc2c(C3CCCCC3)c([nH]c2s1)-c1ccccc1
OC(=O)c1ccc2nc(-c3ccccc3)c(cc2c1)C1CCCCC1
OC(=O)c1cc2n(C3CCCCC3)c(nc2s1)-c1ccccc1
COc1ccc(cc1)-c1nc(\C=C\C(O)=O)cn1C1CCCCC1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ccc(nc12)C(O)=O)-c1ccccc1
OC(=O)c1cc2nc(-c3ccccc3)n(C3CCCCC3)c2[nH]1
OC(=O)c1cc2nc(-c3ccccc3)n(C3CCCCC3)c2s1
OC(=O)c1cnc2c(C3CCCCC3)c([nH]c2c1)-c1ccccc1
OC(=O)c1cc2[nH]c(c(C3CCCCC3)c2s1)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2cc(sc12)C(O)=O)-c1ccccc1
OC(=O)c1ccc2c(C3CCCCC3)c([nH]c2n1)-c1ccccc1
OC(=O)c1ccc2c(C3CCCCC3)c(cn2c1)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2ncc(cc12)C(O)=O)-c1ccccc1
OC(=O)c1ccc2cc(C3CCCCC3)c(nc2c1)-c1ccccc1
CN(C)C(=O)Cn1c(c(C2CCCCC2)c2sc(cc12)C(O)=O)-c1ccccc1
OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)cc(Br)c1O
Cc1cc(NC(=O)c2ccccc2)c(cc1Cl)S(=O)(=O)N1CCC[C@H]1C(O)=O
OC(=O)[C@H]1CCCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
OC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
Oc1c(Cl)cc(Cl)cc1S(=O)(=O)N1CCC[C@H]1C#N
COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(F)cc(Cl)c1O
CC(=O)Nc1cc(C)c(Cl)cc1S(=O)(=O)N1CCC[C@H]1C(O)=O
OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1
OC(=O)[C@H]1CCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
Cc1cc(N)c(cc1Cl)S(=O)(=O)N1CCC[C@H]1C(O)=O
Nc1ccccc1S(=O)(=O)N1CCC[C@H]1C(O)=O
Cc1cc(c(cc1Cl)N)S(=O)(=O)[N@@]2CCC[C@H]2C(=O)O
Oc1c(Cl)cc(Cl)cc1S(=O)(=O)N1CCCC1
OC(=O)[C@H]1CSCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)c(Cl)c(Cl)c1O
OC(=O)[C@@H]1CSCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O
Oc1c(Cl)cc(Cl)cc1S(=O)(=O)N1CCC[C@H]1c1nnn[nH]1
CC(C)c1cccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)c1
O=C1CC(=O)OC(CCc2ccccc2)(C1)C1CCCC1
CCOc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1F
Cc1cc(SC2C(=O)CC(CCc3ccc(O)cc3)(OC2=O)C2CCCC2)c(cc1N)C(C)(C)C
COc1ccc(CCC2(CC(=O)C(Sc3nncn3C)C(=O)O2)C2CCCC2)cc1Cl
CCCC1(CCc2ccc(OC)cc2)CC(=O)CC(=O)O1
Oc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1
COc1ccc(CCC2(CC(=O)C(Sc3nnnn3C)C(=O)O2)C2CCCC2)cc1Cl
Oc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCCC2)cc1
COc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1F
Oc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCC2)cc1
CCc1cccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)c1
COc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1Cl
CC(C)c1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1
CC1(CCc2ccc(O)cc2)CC(=O)CC(=O)O1
CCOc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1
CC(C)Oc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1
COc1ccc(CCC2(CC(=O)C(Sc3nccn3C)C(=O)O2)C2CCCC2)cc1Cl
COc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1
COc1ccc(CCC2(CC(=O)C(Sc3ccccc3)C(=O)O2)C2CCCC2)cc1Cl
CC(C)Oc1ccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)cc1F
Clc1cccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)c1
Cc1cccc(CCC2(CC(=O)CC(=O)O2)C2CCCC2)c1
COc1ccc(CCC2(CC(=O)C(Sc3ccc(O)cc3)C(=O)O2)C2CCCC2)cc1Cl
NC(=O)c1ccc(c(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c1)-c1ccc(Cl)cc1
CC(=O)Nc1ccc(c(COc2ccc(-c3nc4cc(ccc4n3C3CCCCC3)C(O)=O)c(F)c2)c1)-c1ccc(Cl)cc1
Cc1ncc(COc2ccc(cc2)-c2nc3cc(ccc3n2C2CCCCC2)C(O)=O)c(n1)-c1ccc(Cl)cc1
Cc1cc(SC2=C(O)OC(CCc3ccc(O)cc3)(CC2=O)C2CCCC2)c(cc1N)C(C)(C)C |c:5|
COc1cc(OC)c(CCC2(CC(=O)C(Sc3nc4nc(C)cc(C)n4n3)C(=O)O2)C2CCCC2)cc1Cl
Cc1ccc(cc1)S(=O)(=O)NC2=NC(=O)C(=Cc3ccc(o3)C)S2
CCc1ccc(\C=C2\SC(NC(C(O)=O)c3ccc(F)cc3)=NC2=O)o1 |c:22|
CCc1ccc(o1)\C=C/2\C(=O)N=C(S2)N[C@@H](c3ccc(cc3)F)C(=O)O
Cc1ccc(cc1)S(=O)(=O)NC1=NC(=O)\C(S1)=C\C=C\c1ccccn1 |t:12|
Brc1ccc(\C=C2/SC(=S)N(CS(=O)(=O)c3ccccc3)C2=O)cc1
OC(=O)CN1C(=S)S\C(=C/c2cccc(Oc3ccccc3)c2)C1=O
Nc1ccn([C@@H]2O[C@@](CO)(N=[N+]=[N-])[C@@H](O)[C@@H]2O)c(=O)n1 |r|
CCc1cccc2c3CCOC(CC)(Cc4n[nH]c(=S)n4C)c3[nH]c12
CCc1cccc2c3CCOC(CC)(Cc4n[nH]c(=S)n4CC)c3[nH]c12
CCCn1c(CC2(CC)OCCc3c2[nH]c2c(CC)cccc32)n[nH]c1=S
CCCCn1c(CC2(CC)OCCc3c2[nH]c2c(CC)cccc32)n[nH]c1=S
CCc1cccc2c3CCOC(CC)(Cc4n[nH]c(=S)n4CC=C)c3[nH]c12
Cc1cc(C)n2nc(CC3C(=O)CC(CCc4ccc(c(F)c4)C(C)(C)C#N)(OC3=O)C3CCCC3)nc2n1
CCC(CC)(C#N)c1ccc(CCC2(CC(=O)C(Cc3nc4nc(C)cc(C)n4n3)C(=O)O2)C2CCCC2)cc1F
Cc1cc(C)n2nc(CC3C(=O)CC(CCc4ccc(c(F)c4)C(C)(C)O)(OC3=O)C3CCCC3)nc2n1
CCc1cc(cc(n1)CC)CC[C@@]2(CC(=C(C(=O)O2)Cc3nc4nc(cc(n4n3)C)C)O)C5CCCC5
CCc1cc(CC[C@@]2(CC(=O)C(Cc3nc4nc(C)cc(C)n4n3)C(=O)O2)C2CCCC2)cc(CC)n1 |r|
CCc1cc(CC[C@]2(CC(O)=C(Cc3nc4nc(C)cc(C)n4n3)C(=O)O2)C2CCCC2)cc(CC)n1 |r,t:10|
COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1c1nc(c[nH]1)-c1ccc2-c3cc4cc(ccc4n3[C@@H](Oc2c1)c1ccccc1)-c1c[nH]c(n1)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C |r|
CC1(CC1)S(=O)(=O)NC(=O)[C@]2(C[C@H]2C(F)F)NC(=O)[C@@H]3C[C@@H]4CN3C(=O)[C@@H](NC(=O)O[C@@H]5CCC[C@H]5OC/C=C/C(c6c(nc7ccccc7n6)O4)(F)F)C(C)(C)C
Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@@]23CCO3)c(=O)[nH]1
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1F
c1nc2c(n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)F)N=C(NC2=O)N
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](F)[C@H]1O
CC[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c1nc[nH]c2=O
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](CO)C[C@H]1O
c1nc(c2c(n1)n(cn2)[C@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)N
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2cnc(N)nc12
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](CO)[C@@H](F)[C@H]1O
C[C@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12
CO[C@]1(C)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c1nc(N)[nH]c2=O
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2cncnc12
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c1nc(N)[nH]c2=O
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)ncnc12 |r|
C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(N)nc(N)nc12
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)C[C@H]1O |r|
Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](CO)[C@H](O)[C@H]1O |r|
C[C@]1(O)[C@@H](CO)O[C@H]([C@@H]1O)n1cnc2c(N)ncnc12
C[C@@]1(O)[C@@H](CO)O[C@H]([C@@H]1O)n1cnc2c(N)ncnc12 |r|
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1
COc1cccc(Oc2ccc(cc2)C(=O)N(C2CCCCC2)c2ncc(s2)C(O)=O)c1
C[C@@H]1CCCCC1N(C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(cs1)C(O)=O
C[C@@H]1CC(CC(C)(C)C1)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(cs1)C(O)=O
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2cccs2)cc1
OC(=O)c1cnc(s1)N(C1CCSCC1)C(=O)c1ccc(Oc2ccccc2)cc1
COc1ccccc1Oc1ccc(cc1)C(=O)N(C1CCCCC1)c1ncc(s1)C(O)=O
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2ccc(F)cc2)cc1
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(Oc2cccc(c2)C(F)(F)F)cc1
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(Oc2ccccc2)cc1
CC(C)(C)[C@H]1CCC(CC1)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(cs1)C(O)=O |wD:4.3,(3.31,-4.95,;1.76,-4.95,;.22,-4.95,;1.76,-6.49,;1.76,-3.41,;3.09,-2.64,;3.09,-1.1,;1.76,-.33,;.43,-1.1,;.43,-2.64,;1.76,1.21,;.43,1.98,;.43,3.54,;-.9,1.21,;-2.23,1.98,;-3.56,1.21,;-3.56,-.33,;-4.89,-1.12,;-6.25,-.37,;-6.27,1.17,;-7.58,1.95,;-8.95,1.14,;-8.93,-.4,;-7.58,-1.15,;-2.23,-1.1,;-.9,-.33,;3.09,1.98,;4.56,1.52,;5.44,2.77,;4.56,4.01,;3.09,3.54,;6.98,2.77,;7.75,4.12,;7.75,1.45,)|
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2ccccc2F)cc1
COc1ccc(Oc2ccc(cc2)C(=O)N(C2CCCCC2)c2ncc(s2)C(O)=O)cc1OC
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(Oc2cccc(OC(F)(F)F)c2)cc1
C[C@H]1CCC(CC1)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(cs1)C(O)=O |wD:1.0,(1.94,-5.48,;1.94,-3.93,;3.27,-3.17,;3.27,-1.63,;1.94,-.85,;.59,-1.63,;.59,-3.17,;1.94,.68,;.59,1.46,;.59,3,;-.72,.68,;-.72,-.85,;-2.05,-1.63,;-3.4,-.85,;-4.71,-1.64,;-6.07,-.89,;-6.08,.65,;-7.4,1.42,;-8.75,.61,;-8.74,-.93,;-7.39,-1.68,;-3.4,.68,;-2.05,1.46,;3.27,1.46,;4.74,.98,;5.63,2.23,;4.74,3.47,;3.27,3,;7.17,2.24,;7.94,3.59,;7.94,.93,)|
CC(C)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1ncc(s1)C(O)=O
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2ccccc2)cc1
OC(=O)c1csc(n1)N(C1CCCCC1)C(=O)c1ccc(Oc2ccccc2)cc1
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1
OC(=O)c1csc(NC(=O)c2ccc(Oc3ccccc3)cc2)n1
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(Oc2ccc(Cl)cc2)cc1
OC(=O)c1cnc(s1)N(C1CCS(=O)(=O)CC1)C(=O)c1ccc(Oc2ccccc2)cc1
COc1cccc(COc2ccc(cc2)C(=O)N(C2CCCCC2)c2ncc(s2)C(O)=O)c1
C[C@@H]1CC(CC(C)(C)C1)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1ncc(s1)C(O)=O
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2cccc(c2)C(F)(F)F)cc1
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2ccccn2)cc1
COc1ccccc1COc1ccc(cc1)C(=O)N(C1CCCCC1)c1ncc(s1)C(O)=O
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2cccc(F)c2)cc1
OC(=O)c1cnc(NC(=O)c2ccc(Oc3ccccc3)cc2)s1
CC(C)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(cs1)C(O)=O
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OCc2ccccc2C(F)(F)F)cc1
OC(=O)c1cnc(s1)N(C1CCCCC1)C(=O)c1ccc(OC2CCCCC2)cc1
C[C@H]1CC[C@@H](CC1)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1ncc(s1)C(O)=O |r,wU:1.0,wD:4.7,(4.22,-9.1,;4.62,-7.62,;3.53,-6.53,;3.93,-5.04,;5.42,-4.64,;6.51,-5.73,;6.11,-7.22,;5.82,-3.15,;4.73,-2.06,;5.13,-.58,;3.24,-2.46,;2.15,-1.37,;.66,-1.77,;.27,-3.26,;-1.22,-3.66,;-2.31,-2.57,;-3.8,-2.97,;-4.89,-1.88,;-4.49,-.39,;-3,.01,;-1.91,-1.08,;1.36,-4.35,;2.84,-3.95,;7.31,-2.76,;7.86,-1.32,;9.39,-1.4,;9.79,-2.89,;8.5,-3.72,;11.23,-3.44,;11.47,-4.96,;12.43,-2.47,)|
CC(C)(C)[C@H]1CC[C@@H](CC1)N(C(=O)c1ccc(Oc2ccccc2)cc1)c1ncc(s1)C(O)=O |r,wU:4.3,wD:7.10,(5.31,-10.19,;4.22,-9.1,;2.74,-9.5,;3.82,-10.59,;4.62,-7.62,;3.53,-6.53,;3.93,-5.04,;5.42,-4.64,;6.51,-5.73,;6.11,-7.22,;5.82,-3.15,;4.73,-2.06,;5.13,-.58,;3.24,-2.46,;2.15,-1.37,;.66,-1.77,;.27,-3.26,;-1.22,-3.66,;-2.31,-2.57,;-3.8,-2.97,;-4.89,-1.88,;-4.49,-.39,;-3,.01,;-1.91,-1.08,;1.36,-4.35,;2.84,-3.95,;7.31,-2.76,;7.86,-1.32,;9.39,-1.4,;9.79,-2.89,;8.5,-3.72,;11.23,-3.44,;11.47,-4.96,;12.43,-2.47,)|
C[C@H]1CCCC[C@@H]1N(C(=O)c1ccc(Oc2ccccc2)cc1)c1ncc(s1)C(O)=O |r|
Cc1c(-c2ccccn2)n(C2CCCCC2)c2ccc(cc12)C(O)=O
Cn1c(-c2ccoc2)c(C2CCCC2)c2ccc(cc12)C(O)=O
Cn1c(c(C2CCCCC2)c2ccc(nc12)C(O)=O)-c1ccccc1
Cc1c(-c2ccccc2)n(C2CCCCC2)c2ccc(cc12)C(O)=O
Cc1c(-c2ccoc2)n(C2CCCCC2)c2ccc(cc12)C(O)=O
OC(=O)\C=C\c1cc(C2CCCCC2)c([nH]1)-c1ccccn1
COc1c(ccc2c(C3CCCC3)c(-c3ccoc3)n(C)c12)C(O)=O
OC(=O)c1ccc2c(C3CCCC3)c(oc2c1)-c1ccoc1
OC(=O)\C=C\c1cc(-c2ccccn2)n(n1)C1CCCCC1
Cn1c(-c2ccoc2)c(C2CCCCC2)c2ccc(cc12)C(O)=O
Cc1c(-c2ccoc2)n(C2CCCC2)c2cc(ccc12)C(O)=O
Cn1c(-c2ccoc2)c(C2CCCC2)c2ccc(C(O)=O)c(C(O)=O)c12
COC(=O)c1c(ccc2c(C3CCCC3)c(-c3ccoc3)n(C)c12)C(O)=O
OC(=O)c1ccc2c(C3CCCC3)c([nH]c2c1)-c1ccoc1
Cn1c(-c2ccoc2)c(C2CCCCC2)c2ccc(nc12)C(O)=O
Cn1c(-c2ccoc2)c(C2CCCC2)c2ccc(C(O)=O)c(O)c12
Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccccn1
OC(=O)c1ccc2c(C3CCCCC3)c([nH]c2c1)-c1ccoc1
OC(=O)c1ccc2c(C3CCCC3)c(sc2c1)-c1ccoc1
Cn1c(-c2ccoc2)c(C2CCCC2)c2ccc(C(O)=O)c(Cl)c12
OC(=O)c1ccc2C(C3CCCC3)=C(c3ccoc3)S(=O)(=O)c2c1 |t:13|
OC(=O)c1ccc2c(C3CCCCC3)c([nH]c2c1)-c1ccccn1
OC(=O)c1ccc2n(C3CCCC3)c(nc2c1)-c1ccoc1
CN(C)C(=O)CN1CCn2c(c(C3CCCCC3)c3ccc(cc23)C(O)=O)-c2ccccc12
CN1CCn2c(c(C3CCCCC3)c3ccc(cc23)C(O)=O)-c2ccccc12
CC(C)N1CCn2c(c(C3CCCCC3)c3ccc(cc23)C(O)=O)-c2ccccc12
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4SCCn3c2c1
CC(C)(NC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4OCCn3c2c1)C(O)=O
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccc(OCc5ccccc5)cc4OCCn3c2c1
CN(C)CCN1CCn2c(c(C3CCCCC3)c3ccc(cc23)C(O)=O)-c2ccccc12
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4OCn3c2c1
CC(=O)N1CCn2c(c(C3CCCCC3)c3ccc(cc23)C(O)=O)-c2ccccc12
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4NCCn3c2c1
OC(=O)c1ccc2C(C3CCCCC3)=C3C(CCCOc4ccccc34)c2c1 |c:14|
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4Cn3c2c1
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4N(CCc4ccccc4)CCn3c2c1
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4OCCn3c2c1
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4CCCn3c2c1
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4CCn3c2c1
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4N(Cc4ccccc4)CCn3c2c1
OC(=O)c1ccc2c(C3CCCCC3)c3-c4ccccc4N(CCN4CCCCC4)CCn3c2c1
Cn1c(c(C2CCCCC2)c2ccc(cc12)C(O)=O)-c1ccc(OCc2ccccc2)cc1
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CP(O)(=O)OP(O)(=O)OP(O)(O)O)[C@@H](O)[C@H]1O |r|
Nc1ncnc2n(cnc12)[C@@H]1C[C@H](OCP(O)(=O)OP(O)(=O)OP(O)(O)O)[C@@H](O)[C@H]1O |r|
C[C@@]1(O)[C@H](O)[C@@H](CCP(O)(=O)OP(O)(=O)OP(O)(O)O)O[C@H]1n1cnc2c(N)ncnc12 |r|