330 SMILES Strings for Endothelial PAS domain-containing protein 1/Hypoxia-inducible factor 1-alpha

Compound Name
SMILES String
COCCOCc1ccc(CN2CCN(Cc3ccc(cc3)C(=O)Nc3ccc(cc3)C#CC34CC5CC(CC(C5)C3)C4)[C@@H](C)C2)cn1 |r,THB:32:33:36:40.38.39,38:37:34:40.39.41,38:39:36.37.42:34,41:39:36:42.33.34,41:33:36:40.38.39|
COCc1ccc(CN2CCN(Cc3ccc(cc3)C(=O)Nc3ccc(cc3)C#CC34CC5CC(CC(C5)C3)C4)[C@@H](C)C2)cn1 |r,THB:29:30:33:37.35.36,35:34:31:37.36.38,35:36:33.34.39:31,38:36:33:39.30.31,38:30:33:37.35.36|
C[C@H]1CN(Cc2cccnc2)CCN1Cc1ccc(cc1)C(=O)Nc1ccc(cc1)C#CC12CC3CC(CC(C3)C1)C2 |r,THB:31:32:35:39.37.38,37:36:33:39.38.40,37:38:35.36.41:33,40:38:35:41.32.33,40:32:35:39.37.38|
Nc1ncccc1C(=O)N1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(cc2)C#CC23CC4CC(CC(C4)C2)C3)CC1 |THB:30:31:34:38.36.37,36:35:32:38.37.39,36:37:34.35.40:32,39:37:34:40.31.32,39:31:34:38.36.37|
Nc1ncccc1C(=O)N1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(cc2)C#Cc2ccccc2)CC1
O=C(Nc1ccc(cc1)C#CC12CC3CC(CC(C3)C1)C2)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1 |THB:10:11:14:18.16.17,16:15:12:18.17.19,16:17:14.15.20:12,19:17:14:20.11.12,19:11:14:18.16.17|
OC1(CCCCC1)C#Cc1ccc(NC(=O)c2ccc(CN3CCN(Cc4cccnc4)CC3)cc2)cc1
O=C(Nc1ccc(cc1)C#CC1CCCCC1)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1
O=C(Nc1ccc(cc1)C#Cc1cccnc1)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1
O=C(Nc1ccc(cc1)C#Cc1ccccc1)c1ccc(CN2CCN(Cc3cccnc3)CC2)cc1
C[C@H]1CN(Cc2ccc(cc2)C(=O)Nc2ccc(cc2)C(F)(F)F)CCN1Cc1cccnc1 |r|
C[C@@H]1CN(Cc2ccc(cc2)C(=O)Nc2ccc(cc2)C(F)(F)F)CCN1Cc1cccnc1 |r|
C[C@@H]1CN(Cc2cccnc2)CCN1Cc1ccc(cc1)C(=O)Nc1ccc(cc1)C(F)(F)F |r|
C[C@H]1CN(Cc2cccnc2)CCN1Cc1ccc(cc1)C(=O)Nc1ccc(cc1)C(F)(F)F |r|
CN(CCN(C)Cc1cccnc1)Cc1ccc(cc1)C(=O)Nc1ccc(cc1)C(F)(F)F
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCN(Cc4cccnc4)CC3)cc2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CC3CCN(Cc4ccncc4)CC3)cc2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCN(Cc4ccncc4)CC3)cc2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCN(Cc4ccccc4)CC3)cc2)cc1
Ic1ccc(cc1)C(=O)Nc1ccc(CN2CCOCC2)cc1
CN(C(=O)c1ccc(CN2CCOCC2)cc1)c1ccc(I)cc1
Ic1ccc(NCc2ccc(CN3CCOCC3)cc2)cc1
FC(F)(F)c1ccc(\C=C\c2ccc(CN3CCOCC3)cc2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCOCC3)s2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCOCC3)nc2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCOCC3)cn2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccccc2CN2CCOCC2)cc1
FC(F)(F)c1ccc(NC(=O)c2cccc(CN3CCOCC3)c2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)nc1
COc1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1
FC(F)(F)c1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1
Ic1ccc(NC(=O)c2ccc(CN3CCOCC3)cc2)cc1
Ic1cccc(NC(=O)c2ccc(CN3CCOCC3)cc2)c1
Ic1ccccc1NC(=O)c1ccc(CN2CCOCC2)cc1
O=C(Nc1ccccc1)c1ccc(CN2CCOCC2)cc1
Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Ic1cccc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Ic1cccc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Brc1cccc(c1)[C@@H]1C[C@H](c2ccccc2Br)n2nnnc2N1 |r|
Brc1cccc(c1)[C@H]1C[C@@H](c2ccccc2Br)n2nnnc2N1 |r|
Clc1ccccc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Clc1ccccc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
c1cc(cc(c1)Br)[C@@H]2C[C@@H](n3c(nnn3)N2)c4cccc(c4)Br
Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Brc1cccc(c1)[C@@H]1C[C@H](c2cccc(I)c2)n2nnnc2N1 |r|
Brc1cccc(c1)[C@H]1C[C@@H](c2cccc(I)c2)n2nnnc2N1 |r|
Clc1ccc(Br)cc1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Clc1ccc(Br)cc1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Fc1ccc(Br)c(F)c1[C@H]1C[C@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Fc1ccc(Br)c(F)c1[C@@H]1C[C@@H](Nc2nnnn12)c1cccc(Br)c1 |r|
Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2ccccc2)n2nnnc2N1 |r|
Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2ccccc2)n2nnnc2N1 |r|
Fc1cc(Br)cc(c1)[C@@H]1C[C@H](c2cccc(Br)c2)n2nnnc2N1 |r|
Fc1cc(Br)cc(c1)[C@H]1C[C@@H](c2cccc(Br)c2)n2nnnc2N1 |r|
OCc1ccc(s1)-c1nc(-c2ccncc2)c2ccccn12
OCc1ccc(o1)-c1nc(-c2ccccc2)c2ccccn12
OCc1ccc(s1)-c1nc(-c2ccccc2)c2ccccn12
OCc1ccc(o1)-c1nc(-c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c2ccccn12
Cc1ccc(cc1)-c1nc(-c2ccc(CO)o2)n2ccccc12
COc1ccccc1-c1nc(-c2ccc(CO)o2)n2ccccc12
OCc1ccc(o1)-c1nc(Cc2ccccc2)c2ccccn12
OCc1ccc(o1)-c1nc(-c2ccccc2CO)c2ccccn12
OCc1ccc(o1)-c1nc(-c2ccc(cc2)C#N)c2ccccn12
OCc1ccc(s1)-c1nc(-c2ccccc2CO)c2ccccn12
OCc1ccc(o1)-c1nn(Cc2ccccc2)c2ccccc12
OCc1ccc(o1)-c1nc(-c2ccc(cc2)C(F)(F)F)c2ccccn12
COc1ccc(cc1)-c1nc(-c2ccc(CO)o2)n2ccccc12
NC(=O)c1cccc(NC(=O)COc2ccccc2)c1
CC(=O)c1ccc(OCC(=O)Nc2cccc(c2)C(O)=O)cc1
NC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:17:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20|
OC(=O)c1cccc(NC(=O)COc2ccccc2)c1
Clc1ccc(NC(=O)c2cccc(NC(=O)COc3ccc(cc3)C34CC5CC(CC(C5)C3)C4)c2)cc1 |TLB:21:24:27.26.31:29,THB:25:26:29:33.24.32,25:24:27.26.31:29,32:24:27:31.30.29,32:30:27:33.25.24,21:24:27:31.30.29|
OC(=O)c1cccc(NC(=O)COc2ccc(I)cc2)c1
OC(=O)c1cccc(NC(=O)COc2ccc(cc2)-c2cccs2)c1
NC(=O)c1cccc(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:16:19:22.21.26:24,THB:20:21:24:28.19.27,20:19:22.21.26:24,27:19:22:26.25.24,27:25:22:28.20.19|
CC(C)(C)c1ccc(OCC(=O)Nc2cccc(c2)C(N)=O)cc1
Cc1ccc(OCC(=O)Nc2cccc(c2)C(N)=O)cc1
Oc1ccc(cc1NC(=O)COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)C(=O)NCCN1CCOCC1 |TLB:15:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18|
COc1cccc(c1)-c1ccc(OCC(=O)Nc2cccc(c2)C(O)=O)cc1
OC(=O)c1cccc(NC(=O)COc2ccc(Cl)cc2)c1
OC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:17:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20|
COC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:18:21:24.23.28:26,THB:22:23:26:30.21.29,22:21:24.23.28:26,29:21:24:28.27.26,29:27:24:30.22.21|
OC(=O)c1cccc(NC(=O)COc2ccc(Br)cc2)c1
OC(=O)c1ccccc1NC(=O)COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:17:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20|
OC(=O)c1cccc(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:16:19:22.21.26:24,THB:20:21:24:28.19.27,20:19:22.21.26:24,27:19:22:26.25.24,27:25:22:28.20.19,16:19:22:26.25.24|
OC(=O)c1ccc(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)cc1 |TLB:15:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18|
NC(=O)c1cccc(NC(=O)COc2ccc(cc2)[N+]([O-])=O)c1
CN(C)C(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:19:22:25.24.29:27,THB:23:24:27:31.22.30,23:22:25.24.29:27,30:22:25:29.28.27,30:28:25:31.23.22|
OC(=O)c1cccc(NC(=O)COc2ccc(F)cc2)c1
Cc1ccc(OCC(=O)Nc2cccc(c2)C(O)=O)cc1
CC(C)(C)c1ccc(OCC(=O)Nc2cccc(c2)C(O)=O)cc1
O=C(COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)Nc1cccc(c1)C(=O)NCCc1ccncc1 |TLB:7:10:13.12.17:15,THB:11:12:15:19.10.18,11:10:13.12.17:15,18:10:13:17.16.15,18:16:13:19.11.10|
O=C(COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)Nc1cccc(c1)C(=O)Nc1ccc2ccccc2c1 |TLB:7:10:13.12.17:15,THB:11:12:15:19.10.18,11:10:13.12.17:15,18:10:13:17.16.15,18:16:13:19.11.10|
Oc1ccc(cc1NC(=O)COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)C(=O)NCc1ccco1 |TLB:15:18:21.20.25:23,THB:19:20:23:27.18.26,19:18:21.20.25:23,26:18:21:25.24.23,26:24:21:27.19.18|
COC(=O)c1cccc(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:17:20:23.22.27:25,THB:21:22:25:29.20.28,21:20:23.22.27:25,28:20:23:27.26.25,28:26:23:29.21.20,17:20:23:27.26.25|
OC(=O)c1cccc(NC(=O)COc2ccc(cc2)-c2cccc(c2)[N+]([O-])=O)c1
CN(C)CCNC(=O)c1ccc(O)c(NC(=O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)c1 |TLB:22:25:28.27.32:30,THB:26:27:30:34.25.33,26:25:28.27.32:30,33:25:28:32.31.30,33:31:28:34.26.25|
O=C(COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2)Nc1cccc(c1)C(=O)NCc1ccco1 |TLB:7:10:13.12.17:15,THB:11:12:15:19.10.18,11:10:13.12.17:15,18:10:13:17.16.15,18:16:13:19.11.10|
Cc1ccc(cc1)-c1ccc(OCC(=O)Nc2cccc(c2)C(O)=O)cc1
CO[C@H]1C[C@H](C)CC2=C(NCCN(C)C)C(=O)C=C(NC(=O)\C(C)=C\C=C/[C@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)C2=O |r,c:7,25,t:17,23,36|
CC(CO)C1=C(O)C(=O)c2c(ccc3c(C)cccc23)C1=O |c:4|
Cc1cccc2c1ccc3c2C(=O)C(=O)C4=C3OC[C@@H]4C
C[C@@H]1COC2=C1C(=O)C(=O)c1ccc3c(C)cccc3c21 |c:4|
Cc1coc-2c1C(=O)C(=O)c1ccc3c(C)cccc3c-21
CC(C)C1=CC(=O)c2c3CCCC(C)(C)c3ccc2C1=O |t:3|
COC(=O)[C@@]1(C)CCCc2c1ccc1-c3occ(C)c3C(=O)C(=O)c21 |r|
Cc1coc-2c1C(=O)C(=O)c1c3CCCC(C)(C)c3ccc-21
Cc1coc-2c1C(=O)C(=O)c1c-2ccc2c(C)cccc12
CC(C)C1=CC(=O)c2c(ccc3c(C)cccc23)C1=O |t:3|
CC(C)C1=CC(=O)c2c(ccc3c2C=CCC3(C)C)C1=O |c:14,t:3|
C[C@H]1COC2=C1C(=O)C(=O)c1c3CCCC(C)(C)c3ccc21 |c:4|
C[C@H](CO)C1=C(O)C(=O)c2c3CCCC(C)(C)c3ccc2C1=O |c:4|
CCCc1cc(=O)c2c(OC)c3c(OC)cc(OC)cc3cc2o1
CCCc1cc(=O)c2c(O)c3c(OC)cc(O)cc3cc2o1
CCCc1cc(=O)c2c(OC)c3c(OC)cc(O)c(Oc4c(O)cc(OC)c5c(OC)c6c(cc45)oc(CCC)cc6=O)c3cc2o1
CCCc1cc(=O)c2c(O)cc3cc(O)cc(OC)c3c2o1
COc1cc(O)cc2cc3oc(C)cc(=O)c3c(OC)c12
COc1cc(O)cc2cc3oc(C)cc(=O)c3c(O)c12
CCCc1cc(=O)c2c(OC)c3c(OC)cc(O)cc3cc2o1
[H][C@]12C[C@@]3([H])C(CC[C@@]4([H])C(C)(C)CCC[C@]34CO)[C@]3([H])C[C@H](O)[C@@H](C(C)=O)[C@]([H])(C(=O)O1)[C@@]23C
[H][C@@]12CC[C@@]3(C)[C@]4([H])CC=C([C@H](C=O)[C@@]4(C)C(=O)C[C@]3([H])[C@]1(CCCC2(C)C)C(O)=O)C(C)=O |r,c:9|
[H][C@]12C(C)OC(=O)[C@]1([H])[C@@]1(C)[C@H](O)C[C@]3([H])[C@@]4(C)CCCC(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1([H])C[C@@H]2O
COc1ccc2c(O)c(O)ccc2c1-c1c(OC)ccc2c(O)c(O)ccc12 |(-9.35,2.74,;-8.01,1.99,;-6.68,2.77,;-6.7,4.31,;-5.36,5.09,;-4.02,4.33,;-2.71,5.1,;-2.72,6.64,;-1.38,4.35,;-.05,5.13,;-1.37,2.81,;-2.69,2.04,;-4.02,2.8,;-5.35,2.02,;-5.34,.48,;-4,-.28,;-2.67,.5,;-1.33,-.26,;-3.99,-1.83,;-5.33,-2.6,;-6.66,-1.83,;-8,-2.61,;-7.99,-4.15,;-9.33,-1.84,;-10.67,-2.61,;-9.33,-.3,;-8,.48,;-6.67,-.29,)|
[H][C@]12CC[C@](C)(O)[C@@H](Cc3cc(O)ccc3O)[C@]1(C)CC[C@]1([H])[C@]3(C)CCC[C@]21COC3=O
[H][C@]12CC[C@]3(C)[C@]([H])(CC[C@]4(C)Oc5ccc(O)cc5C[C@@]34[H])[C@@]11CCC[C@]2(C)C(=O)OC1
[H][C@]12CC[C@]3(C)[C@]([H])(CC[C@]4(C)Oc5ccc(O)cc5C[C@@]34[H])[C@@]1(C)CCC[C@]2(C)C(O)=O
CC(C)(O)C(O)CC[C@@](C)(C=C)\C=C\c1ccc(O)cc1
[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]([#6])([#6]=[#6])\[#6]=[#6]\c1ccc(-[#8]C([#6])([#6])[#6@@H](-[#8])-[#6]-[#6][C@@]([#6])([#6]=[#6])\[#6]=[#6]\c2ccc(-[#8])cc2)cc1
[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]([#6])([#6]=[#6])\[#6]=[#6]\c1ccc(-[#8])cc1 |r|
[#6]-[#6]-[#8]-c1ccc(\[#6]=[#6]\[C@@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6]=[#6])cc1
[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]([#6])([#6]=[#6])\[#6]=[#6]\c1ccc(-[#8]-[#6](-[#6])=O)cc1
C[C@](CCC1OC1(C)C)(C=C)\C=C\c1ccc(O)cc1
[#6]-[#8]-c1ccc(\[#6]=[#6]\[C@@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6]=[#6])cc1
C[C@H]1CC[C@@H]2C[C@H](C[C@@](O)(O2)[C@@H]2CSC(=O)N2)OC(=O)\C=C(C)/CC\C=C\C=C/1 |c:29,t:22,27|
[H][C@]1(CSC(=O)N1)[C@]1(C[C@@]2([H])C[C@@]([H])(CC[C@H](C)\C=C/C=C/CC\C(C)=C/C(=O)O2)O1)OC(=O)NCc1ccccc1 |c:19,26,t:21|
COc1ccc(cc1OC)[C@@H](O)[C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)[C@H](O)c2ccc3OCOc3c2)c(OC)c1 |r|
COc1cc(ccc1O)[C@@H](O)[C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)[C@H](O)c2ccc3OCOc3c2)c(OC)c1 |r|
CC(CC[C@@H]1[C@@H](C)[C@]2(C)CC[C@@]1(C)O2)C1CCC(C)=C[C@H]1O |r,c:20|
CC[C@@]1(O)C(=O)OCc2c1cc1-c3nc4ccc(O)c(CN(C)C)c4cc3Cn1c2=O |r|
[H][C@]12CCC(=C)[C@@H](CC[C@]3(O)[C@@H](C)CC[C@]4([H])OC(C)(C)C(=O)CC[C@@]34C)[C@]1(C)CC[C@@H](O)C(C)(C)O2 |r|
[H][C@]12CCC(=C)[C@@H](CC[C@]3(O)[C@@H](C)CC[C@]4([H])OC(C)(C)C(=O)CC[C@@]34C)[C@]1(C)CC[C@@H](OC(C)=O)C(C)(C)O2 |r|
[H][C@]1(C[C@@H](O)[C@]2(O1)[C@@H](C)CC[C@]1([H])OC(C)(C)C(=O)CC[C@@]21C)[C@@]1(C)CC[C@]2([H])OC(C)(C)C(=O)CC[C@@]12C |r|
[H][C@]12CCC(C)=C(CCC34CCC(=O)C(C)(C)C3=C(O)C(=O)C(C)=C4C)[C@]1(C)CCC(=O)C(C)(C)O2 |r,c:24,t:5,18|
[H][C@]12CC[C@@H](C)[C@@H](CCC3=C(C)C(=O)C(O)=C4C(C)(C)C(=O)CC[C@]34C)[C@]1(C)CCC(=O)C(C)(C)O2 |r,c:9,t:15|
[H][C@]12CC[C@](C)(O)[C@@H](CCC3=C(C)C(=O)C(O)=C4C(C)(C)C(=O)CC[C@]34C)[C@]1(C)CCC(=O)C(C)(C)O2 |r,c:10,t:16|
[H][C@]12CCC(C)=C(CCC3=C(C)CC[C@]4([H])OC(C)(C)C(=O)CC[C@@]34C)[C@]1(C)CC[C@@H](O)C(C)(C)O2 |r,c:9,t:5|
[H][C@]12CCC(C)=C(CCC3=C(C)C(=O)C(O)=C4C(C)(C)C(=O)CC[C@]34C)[C@]1(C)CCC(=O)C(C)(C)O2 |r,c:9,t:5,15|
[H][C@@]12CC[C@H](C)[C@@](CC[C@]3(C)[C@H](C)CC[C@@]4([H])OC(C)(C)[C@H](O)CC=C34)(O1)[C@@]2(C)CCC(=O)C(C)C |r,t:24|
[H][C@]12CC[C@H](C)[C@](C)(CC[C@]3(C)[C@@H](C)CC[C@]4([H])OC(C)(C)[C@@]5(O)CC[C@@]34O5)C1=CC[C@H](O)C(C)(C)O2 |r,c:32|
[H][C@]1(CC[C@]2(O1)[C@@H](C)CC[C@]1([H])OC(C)(C)C(=O)CC[C@@]21C)[C@@]1(C)CC[C@]2([H])OC(C)(C)C(=O)CC[C@@]12C |r|
CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@@H]1NCCc2cc(O)c(OC)cc12 |r|
CC[C@H]1CN2CCc3cc(c(cc3[C@@H]2C[C@@H]1C[C@@H]4c5cc(c(cc5CCN4)OC)OC)OC)OC
C[C@H]1C[C@@H](C(=O)[C@@H](C1)[C@@H](CC2CC(=O)NC(=O)C2)O)C
[H][C@@]12C[C@H](C[C@@]3(O)NCCc4cc(O)c(OC)cc34)[C@@H](CC)CN1CCc1cc(O)c(OC)cc21 |r|
[H][C@]12CCCCN1Cc1c([C@H]2O)c2cc(OC)c(OC)cc2c2cc(OC)ccc12 |r|
COc1ccc2c(c1)c3cc(c(cc3c4c2CN5CCCC[C@@H]5C4)OC)OC
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)-[#6@@H]-2-[#6]-[#6@H](-[#6](-[#6])=[#6]-[#6@H]-2-c2c(-[#8])ccc(-[#6](=O)\[#6]=[#6]\c3ccc(-[#8])cc3-[#8])c2-[#8])-c2ccc(-[#8])cc2)c1-[#8] |r,c:17|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(cc1-[#8])-[#6](=O)-[#6@@H]-1-[#6@H](-[#6]-[#6](-[#6])=[#6]-[#6@@H]-1-c1c(-[#8])ccc(-[#6](=O)-[#6]=[#6]-c2ccc(-[#8])cc2)c1-[#8])-c1ccc(-[#8])cc1-[#8] |r,w:30.31,c:20|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(cc1-[#8])-[#6](=O)-[#6@@H]-1-[#6@H](-[#6]-[#6](-[#6])=[#6]-[#6@@H]-1-c1c(-[#8])ccc(-[#6](=O)-[#6]=[#6]-c2ccc(-[#8])cc2-[#8])c1-[#8])-c1ccc(-[#8])cc1-[#8] |r,w:30.31,c:20|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(cc1-[#8])-[#6](=O)-[#6@@H]-1-[#6@H](-[#6]-[#6](-[#6])=[#6]-[#6@@H]-1-c1c(-[#8])ccc(-[#6](=O)-[#6]=[#6]-c2ccc(-[#8])cc2)c1-[#8])-c1ccc(-[#8])cc1 |r,w:30.31,c:20|
CC(C)(O)C1Cc2cc3cc(oc3cc2O1)-c1cc(O)cc(O)c1
CC1(C)Oc2cc3oc(cc3cc2C[C@H]1O)-c1cc(O)cc(O)c1 |r|
COc1c(O)cc2oc(cc2c1CC(=O)C(C)C)-c1cc(O)cc(O)c1
[H][C@]12CC(=C[C@](C)(C1)Oc1cc(O)ccc21)c1c(O)cc(cc1O)-c1cc2ccc(O)cc2o1 |r,c:3|
[H][C@]12CC(C)=C[C@@]3([H])c4c(O)cc(cc4O[C@](Oc4cc(O)ccc14)(c1ccc(O)cc1O)[C@@]23[H])-c1cc2ccc(O)cc2o1 |r,c:4|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])cc1-c1cc2ccc(-[#8])cc2o1
[#6]\[#6](-[#6])=[#6]/[#6][C@]12[#8]-c3cc(-[#8])c(-[#6@H]-4-[#6]=[#6](-[#6])-[#6]-[#6@@H](-[#6@H]-4-[#6](=O)-c4ccc(-[#8])cc4-[#8])-c4ccc(-[#8])cc4-[#8])c(-[#8])c3-[#6](=O)[C@@]1([#8])[#8]-c1cc(-[#8])ccc21 |r,t:13|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc2cc(oc12)-c1cc(-[#8])cc(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]
Oc1ccc2cc(oc2c1)-c1cc(O)cc(O)c1
[#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]/[#6]-[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])cc(-[#8])cc1-c1cc2ccc(-[#8])cc2o1
[#6]\[#6](-[#6])=[#6]/[#6][C@@]12[#8]-c3cc(-[#8])c(-[#6@H]-4-[#6]=[#6](-[#6])-[#6]-[#6@@H](-[#6@H]-4-[#6](=O)-c4ccc(-[#8])cc4-[#8])-c4ccc(-[#8])cc4-[#8])c(-[#8])c3-[#6](=O)[C@]1([#8])[#8]-c1cc(-[#8])ccc21 |r,t:13|
[H][C@@]1(CC[C@]2(O)[C@]3([H])CC[C@]4(O)C[C@H](CC[C@]4(C=O)[C@@]3([H])CC[C@]12C)O[C@]1([H])O[C@H](C)C[C@@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H]1OC)C1=CC(=O)OC1 |r,t:55|
COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO |r|
[H][C@@]12CC[C@]3(O)C[C@H](CC[C@]3(C=O)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@]21O)C1=CC(=O)OC1)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O |t:28|
[H][C@@]12CC[C@]3(O)C[C@H](CC[C@]3(C=O)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@]21O)C1=CC(=O)OC1)O[C@H]1C[C@H](OC)[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](C)O1 |t:28|
[H][C@@]12CC[C@]3(O)C[C@@H](O)CC[C@]3(C=O)[C@@]1([H])CC[C@]1(C)[C@H](CC[C@]21O)C1=CC(=O)OC1 |r,t:29|
[H][C@@]12CC[C@@]3(C)[C@]4([H])CC=C([C@H](C=O)[C@@]4(C)C(=O)C[C@]3([H])[C@@]1(CO)CCCC2(C)C)C(C)=O |r,c:9|
[H][C@@]12CC[C@@]3(C)[C@]4([H])CC=C([C@H](C=O)[C@@]4(C)[C@@H](O)C[C@]3([H])[C@@]1(CO)CCCC2(C)C)C(C)=O |r,c:9|
[H][C@@]12CC[C@@]3(C)[C@]4([H])CC=C([C@H](C=O)[C@@]4(C)C(=O)C[C@]3([H])[C@]1(CCCC2(C)C)C(=O)OC)C(C)=O |r,c:9|
C\C(CCCC1=CC(=O)OC1)=C/CC\C(C)=C\CCc1ccoc1 |t:5|
O=Cc1ccc(CCCCCCCCCCCC\C=C/C\C=C/CCCCC#N)[nH]1
O=Cc1ccc(CCCCCCCCCCCCCC\C=C/C\C=C/CCCCC#N)[nH]1
O=Cc1ccc(CCCCCCCCCCCCCCCC#N)[nH]1
O=Cc1ccc(CCCCCCCCCCC\C=C/CCCCCCC#N)[nH]1
CC\C=C/C\C=C/C\C=C/CCCCCCCCCCCc1ccc(C=O)[nH]1
CC\C=C/C\C=C/C\C=C/CCCCCCCCCc1ccc(C=O)[nH]1
CC(C)CCCCCCCCC\C=C/CCc1ccc(C=O)[nH]1
CCCCCCCCCCCCCCc1ccc(C=O)[nH]1
O=Cc1ccc(CCCCCCCCCC\C=C/C\C=C/CCCCC#N)[nH]1
O=Cc1ccc(CCCCCCCCCCCCCCCCCC#N)[nH]1
CC(C)CCCCCCCCCCCCc1ccc(C=O)[nH]1
CC(C)CCCCC\C=C/CCCCCCc1ccc(C=O)[nH]1
CCC\C=C/C\C=C/CCCCCCCCCc1ccc(C=O)[nH]1
[H][C@@]1(CC[C@@]([H])(O1)[C@H](O)CCCC[C@H](O)CCCCC[C@@H](O)CC1=CC(C)OC1=O)[C@H](O)CCCCCCCCCCCC |r,t:24|
[H][C@@]1(CC[C@@]([H])(O1)[C@@]1([H])CC[C@@]([H])(O1)[C@H](O)CCC(O)CCCCCC(O)CC1=CC(C)OC1=O)[C@H](O)CCCCCCCCCCCC |r,t:30|
FC(F)(F)[#8]-c1ccc(-[#7]\[#7]=[#6](\C#N)C#N)cc1
[#6]-[#6]-[#6](-[#6])-[#6](=O)-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c(cc(=O)oc12)-[#6](-[#6]-[#6])-[#8]-[#6](-[#6])=O
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8])-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8])-c1cc(=O)oc2c(-[#6](=O)-[#6]-[#6](-[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6](=O)-[#6]-[#6](-[#6])-[#6])c(-[#8])c12
[#6]-[#6]-[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6](=O)-[#6]-[#6](-[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12
[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6](=O)-[#6@H](-[#6])-[#6]-[#6])c(-[#8])c12 |r|
[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6](=O)-[#6]-[#6](-[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12
[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12 |r|
[#6]-[#6]-[#6@H](-[#6])-[#6](=O)-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2oc(=O)cc(-c3ccccc3)c2c1-[#8] |r|
[#6]-[#6]-[#6@H](-[#6])-[#6](=O)-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c(cc(=O)oc12)-c1ccccc1 |r|
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8]-[#6])-c1cc(=O)oc2c(-[#6]-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8]-[#6])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8])-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8]-[#6])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8])-c1cc(=O)oc2c(-[#6]-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8]-[#6])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8]-[#6](-[#6])=O)-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8]-[#6](-[#6])=O)c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6](=O)-[#6@H](-[#6])-[#6]-[#6])c(-[#8])c12 |r|
[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6](=O)-[#6]-[#6](-[#6])-[#6])c(-[#8])c12
[#6]-[#6](-[#6])-[#6]-[#6](=O)-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c(cc(=O)oc12)-c1ccccc1
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8]-[#6](-[#6])=O)-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8]-[#6](-[#6])=O)c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8]-[#6](-[#6])=O)-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8]-[#6](-[#6])=O)c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8]-[#6](-[#6])=O)c12 |r|
[#6]-[#6](-[#6])-[#6]-[#6](=O)-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2oc(=O)cc(-c3ccccc3)c2c1-[#8]
[#6]-[#6]-[#6]-[#6]-[#6@H](-[#8]-[#6])-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8]-[#6])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6])c12 |r|
[#6]-[#6]-[#6]-[#6]-[#6]-c1cc(=O)oc2c(-[#6](=O)-[#6@@H](-[#6])-[#6]-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c12 |r|
CC(C)CN(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1cccc2ccccc12 |c:14|
CC(C)CN(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |c:14|
COc1ccc(cc1OC)S(=O)(=O)N(CC(C)C)Cc1ccc2OC(C)(C)C=Cc2c1 |c:28|
CC1(C)Oc2ccc(CN(Cc3ccccc3)S(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)cc2C=C1 |c:37|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)c1ccccc1 |c:24|
COc1ccc(c(OC)c1)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)C1CCCCC1 |c:24|
COc1ccc(c(OC)c1)S(=O)(=O)N(CC(C)C)Cc1ccc2OC(C)(C)C=Cc2c1 |c:28|
CC(C)CN(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1cc(Cl)ccc1Cl |c:14|
[H][C@]1(OC1(C)C)[C@@]1([H])C[C@]([H])(C(O)O1)[C@@]1([H])CC[C@]23C[C@]12CC[C@]1([H])[C@@]2(C)CC[C@@H](OC(=O)CC(C)C)C(C)(C)[C@]2([H])C[C@@H](O)[C@@]31C |r|
[H][C@]1([#8]C1([#6])[#6])[C@@]1([H])[#6][C@]([H])([#6](-[#8])-[#8]1)[C@@]1([H])[#6]-[#6][C@]23[#6][C@]12[#6]-[#6][C@]1([H])[C@@]2([#6])[#6]-[#6]-[#6@@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])C([#6])([#6])[C@]2([H])[#6]-[#6@@H](-[#8])[C@@]31[#6] |r|
COc1ccc(NCc2ccc3OC(C)(C)C=Cc3c2)cc1OC |c:16|
CC1(C)Oc2ccc(CNc3ccccc3Br)cc2C=C1 |c:21|
CC1(C)Oc2ccc(CNc3ccccc3F)cc2C=C1 |c:21|
CN(Cc1ccc2OC(C)(C)C=Cc2c1)c1ccccn1 |c:11|
CN(Cc1ccc2OC(C)(C)C=Cc2c1)c1ccc(C)cc1C |c:11|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)C(C)C |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)C(C)(C)C |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)C1CCCC1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)C1CC1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)C1CCCCC1 |c:24|
Cc1cc(C)cc(c1)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)c1ccccc1 |c:22|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc(Br)cc3OC(F)(F)F)cc2C=C1 |c:36|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)Cc2c1)c1ccccc1
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)Cc2c1)C(C)C
COc1ccc(cc1OC)S(=O)(=O)N(Cc1cnc2OC(C)(C)C=Cc2c1)c1ccccc1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1cnc2OC(C)(C)C=Cc2c1)C1CCCCC1 |c:24|
CCCCN(Cc1ccc2OC(C)(C)C=Cc2n1)S(=O)(=O)c1ccc(OC)c(OC)c1 |c:14|
COc1ccc(cc1OC)N(Cc1ccc2OC(C)(C)C=Cc2n1)S(=O)(=O)c1ccc(OC)c(OC)c1 |c:21|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)C1CCCCC1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)C1CCCCCCC1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)C1CCC1 |c:24|
CC(C)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1ccccc1 |c:16|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)C3CC3)nc2C=C1 |c:27|
CCCS(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1ccccc1 |c:16|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc(cc3)-c3ccccc3)nc2C=C1 |c:37|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3cccc4cccnc34)nc2C=C1 |c:35|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc4OCCOc4c3)nc2C=C1 |c:35|
COc1ccc(cc1)S(=O)(=O)N(Cc1cc2C=CC(C)(C)Oc2cn1)c1ccccc1 |c:17|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1cc2C=CC(C)(C)Oc2cn1)C1CCCCC1 |c:19|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1cnc2ccccc2c1)c1ccccc1
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)C1CCCC1 |c:24|
CC1(C)Oc2ccc(CNc3ccccn3)cc2C=C1 |c:20|
COc1ccc(cc1OC)S(=O)(=O)N(CC#C)Cc1ccc2OC(C)(C)C=Cc2c1 |c:27|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3cc(Cl)ccc3Cl)cc2C=C1 |c:32|
CCCCN(Cc1ccc2OC(C)(C)Cc2c1)S(=O)(=O)c1ccc(OC)c(OC)c1
CC(C)CS(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1ccccc1 |c:17|
Cc1ccc(NCc2ccc3OC(C)(C)C=Cc3c2)c(C)c1 |c:15|
COc1ccc(cc1OC)N(C)Cc1ccc2OC(C)(C)C=Cc2c1 |c:22|
CCCCN(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1ccc(OC)c(OC)c1 |c:14|
COc1ccc(cc1OC)S(=O)(=O)N(CCC(C)C)Cc1ccc2OC(C)(C)C=Cc2c1 |c:29|
COc1ccc(cc1)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)c1ccccc1 |c:22|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)Cc2c1)C1CCCC1
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1ccccc1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)C1CCCCCC1 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1ccc(F)cc1 |c:24|
CCCCS(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1ccccc1 |c:17|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc4OCOc4c3)nc2C=C1 |c:34|
CC1(C)Oc2ccc(CNc3ccc(cc3)C(O)=O)cc2C=C1 |c:23|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)Cc2c1)C1CCCCCC1
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2n1)c1cccc2CCCCc12 |c:24|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)Cc2c1)C1CCCCC1
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)C3CCCCC3)nc2C=C1 |c:30|
COc1ccc(cc1OC)S(=O)(=O)N(CC=C)Cc1ccc2OC(C)(C)C=Cc2c1 |c:27|
CC(C)c1ccc(cc1)S(=O)(=O)N(Cc1cc2C=CC(C)(C)Oc2cn1)C1CCCCC1 |c:18|
CC1(C)Oc2cnc(CN(c3ccccc3)S(=O)(=O)c3ccc(cc3)[N+]([O-])=O)cc2C=C1 |c:33|
CCC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc(OC)c(OC)c3)cc2C=C1 |c:35|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc(F)cc3)cc2C=C1 |c:31|
CC1(C)Oc2ccc(CN(c3ccc(F)cc3)S(=O)(=O)c3ccc(F)cc3)cc2C=C1 |c:32|
CC1(C)Oc2ccc(CN(c3ccc(F)cc3)S(=O)(=O)c3cc(Cl)ccc3Cl)cc2C=C1 |c:33|
CC(C)N(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O |c:13|
CC(C)N(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1ccc(F)cc1 |c:13|
CC(C)N(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1cc(Cl)ccc1Cl |c:13|
CC1(C)Oc2ccc(CN(c3ccc(F)cc3)S(=O)(=O)c3ccccc3)cc2C=C1 |c:31|
CC1(C)Oc2ccc(CN(c3ccc(F)cc3)S(=O)(=O)c3ccc(cc3)[N+]([O-])=O)cc2C=C1 |c:34|
CC(C)N(Cc1ccc2OC(C)(C)C=Cc2c1)S(=O)(=O)c1ccccc1 |c:13|
COc1ccc(cc1OC)S(=O)(=O)N(Cc1ccc2OC(C)(C)C=Cc2c1)c1ccc(F)cc1 |c:24|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccc(cc3)[N+]([O-])=O)cc2C=C1 |c:33|
CC1(C)Oc2ccc(CN(c3ccccc3)S(=O)(=O)c3ccccc3)cc2C=C1 |c:30|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3C(=O)C=CC(=O)c3cc21 |r,c:19|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3C(=O)C(CO)=CC(=O)c3cc21 |r,c:21|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3C(=O)C=C(CO)C(=O)c3cc21 |r,t:19|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3C(=O)C4=NCCS(=O)(=O)C4C(=O)c3cc21 |r,t:19|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3C(O)=C4C(=NCCS4(=O)=O)C(=O)c3cc21 |c:18,20|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3c(O)ccc(OS(O)(=O)=O)c3cc21 |r|
C[C@@]12CCCc3coc(c13)C(=O)c1cc3C(=O)CCC(=O)c3cc21 |r|
S=C=NCCc1ccccc1
CCn1ncc(NC(=O)c2ccc(Cn3nc(C)cc3C)o2)c1C(N)=O
CCn1cc(NC(=O)c2ccc(Cn3nc(C)c(Cl)c3C)o2)c(n1)C(N)=O
CCn1cc(NC(=O)c2ccc(Cc3c(C)noc3C)o2)c(n1)C(N)=O
CCn1cc(NC(=O)c2ccc(Cn3cccn3)o2)c(n1)C(N)=O
Cc1cc(C)n(Cc2ccc(o2)C(=O)Nc2c[nH]nc2C(N)=O)n1
CCn1cc(NC(=O)c2ccc(Cn3nc(C)cc3C)o2)c(n1)C(=O)N(C)C
CCn1cc(NC(=O)c2ccc(Cn3nc(C)cc3C)s2)c(n1)C(N)=O
CCn1cc(NC(=O)c2ccc(Cn3nc(C)cc3C)o2)c(n1)C(=O)NC
Cc1cc(C)n(Cc2ccc(o2)C(=O)Nc2cnn3CCNC(=O)c23)n1
CCn1cc(NC(=O)c2cccc(Cn3nc(C)cc3C)c2)c(n1)C(N)=O
CCn1cc(NC(=O)c2ccc(Cn3nc(C)c(Br)c3C)o2)c(n1)C(N)=O
CCn1cc(NC(=O)c2ccc(Cn3nc(C)cc3C)o2)c(n1)C(N)=O
COc1ccc(cc1O)C(=O)[C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)C(=O)c2ccc(OC)c(O)c2)c(OC)c1 |r|
COc1cc(ccc1O[C@H](C)[C@H](O)c1ccccc1)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)[C@H](O)c2ccccc2)c(OC)c1 |r|
CO[C@@H](COc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(OC[C@H](OC)c2ccc(OC)c(OC)c2)c(OC)c1)c1ccc(OC)c(OC)c1 |r|
COc1ccc(cc1OC)[C@@H](O)COc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(OC[C@H](O)c2ccc(OC)c(OC)c2)c(OC)c1 |r|
COc1ccc(cc1OC)[C@@H](O)[C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(OC)c(OC)c1 |r|
COc1ccc(cc1OC)C(=O)COc1cc(ccc1OC)C(=O)[C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)C(=O)c2ccc(OC)c(OCC(=O)c3ccc(OC)c(OC)c3)c2)c(OC)c1 |r|
COc1ccc(cc1OC)[C@@H](O)[C@@H](C)Oc1ccc(cc1O)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)[C@H](O)c2ccc(OC)c(OC)c2)c(OC)c1 |r|
COc1cc(ccc1O[C@H](C)C(=O)c1ccccc1)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)C(=O)c2ccccc2)c(OC)c1 |r|
CO[C@@H]([C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)[C@H](OC)c2ccc(OC)c(OC)c2)c(OC)c1)c1ccc(OC)c(OC)c1 |r|
COc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)C(=O)c2ccc(OC)c(OC)c2)c(OC)c1 |r|
COc1ccc(CCOc2ccc(cc2OC)[C@H]2O[C@@H]([C@H](C)[C@H]2C)c2ccc(OCCc3ccc(OC)c(OC)c3)c(OC)c2)cc1OC |r|
COc1ccc(cc1OC)C(=O)[C@@H](C)Oc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(O[C@H](C)C(=O)c2ccc(OC)c(OC)c2)c(OC)c1 |r|
COc1ccc(cc1OC)C(=O)COc1ccc(cc1OC)[C@H]1O[C@@H]([C@H](C)[C@H]1C)c1ccc(OCC(=O)c2ccc(OC)c(OC)c2)c(OC)c1 |r|