4948 SMILES Strings for Tyrosine-protein phosphatase non-receptor type 1

Compound Name
SMILES String
CCc1c(c2ccccc2o1)C(=O)c3cc(c(c(c3)Br)O)Br
CCc1oc2ccccc2c1C(=O)c1ccc(O)cc1
CCCCc1oc2ccccc2c1C(=O)c1ccc(O)cc1
CCCC[C@H](NC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OS(O)(=O)=O)cc1)NC(=O)CCC(O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)CCC(O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCC(O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)CCC(O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCC(O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OCC(=O)OC)c(c1)C(=O)OC)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCC(=O)OC |r|
CCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1[nH]ncc1=S |r|
CC1(C=Cc2c(ccc3c2OC[C@H](C3)c4ccc(cc4O)O)O1)C
CC1(C)Oc2ccc(C=O)c(OC(=O)c3ccccc3)c2C=C1 |c:23|
COCOc1c(C)cccc1OC(C)=O
CC(=O)Oc1ccc(C)c(C)c1OCc1ccccc1
CCC1(CC)Oc2ccc(C=O)c(OC(=O)c3ccccc3)c2C=C1 |c:25|
CCCOc1ccc(C2COc3c(C2)ccc2OC(C)(C)CCc32)c(O)c1
CCCCOc1ccc(C2COc3c(C2)ccc2OC(C)(C)CCc32)c(O)c1
CCCCCOc1ccc(C2COc3c(C2)ccc2OC(C)(C)CCc32)c(O)c1
COCOc1ccc(C2COc3c(C2)ccc2OC(C)(C)CCc32)c(O)c1
OS([O-])(=O)=c1ccc2[nH+]c(=O)\c(=N/Nc3ccccc3[N+]([O-])=O)c2c1
OC(=O)c1ccc2NC(=O)C(=NNc3ccccc3C(O)=O)c2c1 |w:11.11|
OC(=O)c1ccc2NC(=O)C(=NNc3cccc(c3)C(O)=O)c2c1 |w:11.11|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)C(=O)NCc2ccc(Cl)cc2)c1 |w:9.8|
CC(C)NS(=O)(=O)c1ccc2NC(=O)C(=NNc3cccc(c3)C(O)=O)c2c1 |w:15.15|
CC(C)NS(=O)(=O)c1ccc2NC(=O)C(=NNc3ccc(cc3)C(O)=O)c2c1 |w:15.15|
NS(=O)(=O)c1ccc2NC(=O)C(=NNc3ccccc3[N+]([O-])=O)c2c1 |w:12.12|
[O-][N+](=O)c1ccccc1NN=C1C(=O)Nc2ccc(cc12)S(=O)(=O)NCc1ccc(Cl)cc1 |w:10.10|
Cc1ccc(CNS(=O)(=O)c2ccc3NC(=O)C(=NNc4cccc(c4)C(O)=O)c3c2)cc1 |w:18.18|
OC(=O)c1ccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccccc2)cc1 |w:8.7|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2cccc(Cl)c2)c1 |w:9.8|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(Cl)cc2)c1 |w:9.8|
OC(=O)c1ccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(Cl)cc2)cc1 |w:8.7|
OC(=O)c1ccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccccc2Cl)cc1 |w:8.7|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccccc2Cl)c1 |w:9.8|
OC(=O)c1ccccc1NN=C1C(=O)Nc2ccc(cc12)S(=O)(=O)NCc1ccc(Cl)c(c1)C(F)(F)F |w:10.10|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(F)cc2)c1 |w:9.8|
OC(=O)c1ccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(F)cc2)cc1 |w:8.7|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(F)c(Cl)c2)c1 |w:9.8|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCCc2ccc(Cl)cc2Cl)c1 |w:9.8|
OC(=O)c1ccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(Cl)c(c2)C(F)(F)F)cc1 |w:8.7|
OC(=O)c1cccc(NN=C2C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(Cl)c(c2)C(F)(F)F)c1 |w:9.8|
COc1cc(oc1C1=c2[nH]c3=CCCCCCCC[C@@H]1[C@@H](C(C)C)c2c3)-c1[nH]ccc1Cl |r,w:11.12,c:8|
COc1cc(oc1C1=c2[nH]c3=CCCCCCCC[C@H]1[C@H](C(C)C)c2c3)-c1[nH]ccc1Cl |r,w:11.12,c:8|
CC(C)[C@@H]1[C@H]2CCCCCCCC=c3cc1c([nH]3)=C2c1ccc(o1)-c1ccc[nH]1 |r,w:12.11,c:19|
C\C(=C1/C=CC=N1)c1ccc(o1)-c1[nH]ccc1Cl |c:3,5|
C\C(=C1/C=CC=N1)c1ccc(o1)-c1ccc[nH]1 |c:3,5|
CCC1=CC2=N\C1=C/c1ccc(CCCCCCCCCc3ccc2[nH]3)[nH]1 |c:4,t:2,7|
COC1=CC2=N\C1=C/c1ccc(CCCC\C=C\CCCc3ccc2o3)[nH]1 |c:4,t:2,7,17|
COC1=CC2=N\C1=C/c1ccc(CCCC\C=C\CCCCCCCCCCc3ccc2o3)[nH]1 |c:4,t:2,7,17|
COC1=CC2=N\C1=C/c1ccc(CCCC\C=C\CCCc3cccc2c3)[nH]1 |c:4,t:2,7,17|
COC1=CC(=N\C1=C/c1ccc(CCCCC=C)[nH]1)c1ccc(CCCC=C)[nH]1 |c:4,t:2|
COC1=CC(=NC1=Cc1ccc(CCCCC=C)[nH]1)c1ccc([nH]1)C(=O)CCC=C |w:7.8,c:4,t:2|
COC1=CC(=N\C1=C/c1ccc(CCCCC=C)[nH]1)c1ccc([nH]1)C(\C)=C/CC=C |c:4,t:2|
COC1=CC(=N\C1=C/c1ccc(CCCCC=C)[nH]1)c1ccc[nH]1 |c:4,t:2|
CCc1ccc(\C=C2/N=C(C=C2OC)c2ccc[nH]2)[nH]1 |c:8,10|
COC1=CC(=N\C1=C/c1ccc(CCCCC=C)[nH]1)c1ccc(CCCC=C)s1 |c:4,t:2|
COC1=CC(=O)N\C1=C/c1ccc(CCCCC=C)[nH]1 |t:2|
CCc1ccc(\C=C2/NC(=O)C=C2OC)[nH]1 |c:11|
COC1=CC(=O)N\C1=C/c1ccc(CCCC\C=C\CCCCC(O)=O)[nH]1 |t:2|
COc1cc(\C=C2/SC(=S)N(C2=O)c2ccccc2)cc(c1O)N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2ccc(Cl)cc2)cc(c1O)N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(F)c2)cc(c1O)N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(C)c2)cc(c1O)N(=O)=O
COc1cccc(c1)N1C(=S)S\C(=C/c2cc(OC)c(O)c(c2)N(=O)=O)C1=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2ccc(O)cc2)cc(c1O)N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2ccc(C)cc2)cc(c1O)N(=O)=O
COc1ccc(cc1)N1C(=S)S\C(=C/c2cc(OC)c(O)c(c2)N(=O)=O)C1=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2ccc(cc2)N(=O)=O)cc(c1O)N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2ccc(Cl)c(Cl)c2)cc(c1O)N(=O)=O
Oc1ccc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)cc1N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)ccc1O
Oc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)cc(c1O)N(=O)=O
COc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)cc(C(O)=O)c1O
COc1cc(C=C2SC(=S)N(C2=O)c2cccc(Cl)c2)cc(CP([O-])([O-])=O)c1O |w:5.4|
COc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)cc(c1O)N(=O)=O
COc1c(ccc2OC(C)(C)C=Cc12)C1=NOC(C1)c1ccccc1 |c:11,t:16|
COc1ccc(cc1)C1CC(=NO1)c1ccc2OC(C)(C)C=Cc2c1OC |c:11,23|
COc1c(ccc2OC(C)(C)C=Cc12)C1=NOC(C1)c1ccccn1 |c:11,t:16|
COc1cc(C=O)ccc1C1=NOC(C1)c1ccccc1 |t:11|
COc1ccc(cc1)C1CC(=NO1)c1ccc(C=O)cc1OC |c:11|
COc1cc(C=O)ccc1C1=NOC(C1)c1ccccn1 |t:11|
COc1cc(C=O)ccc1C1=NOC(C1)c1ccncc1 |t:11|
COc1cc(C=O)ccc1C1=NOC(C1)n1ccnc1 |t:11|
COC(=O)C1C(ON=C1c1ccc(C=O)cc1OC)c1ccccc1 |c:7|
CC(=O)Oc1ccc(C2=NOC(C2)c2ccccc2)c(OC(C)=O)c1 |t:8|
COc1ccc(cc1)C1CC(=NO1)c1ccc(OC)cc1OC |c:11|
COC(=O)C1C(ON=C1c1ccc(OC)cc1OC)c1ccccc1 |c:7|
COc1ccc(C2=NOC(C2)n2ccnc2)c(OC)c1 |t:6|
COc1ccc(C2=NOC(C2)c2ccncc2)c(OC)c1 |t:6|
COc1ccc(C2=NOC(C2)c2ccccc2)c(OC)c1 |t:6|
COc1ccc(C2=NOC(C2)c2ccccn2)c(OC)c1 |t:6|
COc1c(ccc2occc12)C1=NOC(C1)c1ccccc1 |t:13|
COc1ccc(cc1)C1CC(=NO1)c1ccc2occc2c1OC |c:11|
Clc1cccc(COc2ccccc2\C=C2/NC(=O)NC2=O)c1
Clc1ccc(COc2ccccc2\C=C2/NC(=O)NC2=O)cc1
Clc1ccc(COc2ccccc2\C=C2/NC(=O)NC2=O)c(Cl)c1
O=C1NC(=O)\C(N1)=C\c1cccc(OCc2ccccc2)c1
O=C1NC(=O)\C(N1)=C\c1cccc(OCCc2ccccc2)c1
O=C1NC(=O)\C(N1)=C\c1cccc(OCCCc2ccccc2)c1
Clc1ccc(COc2cccc(\C=C3/NC(=O)NC3=O)c2)cc1
Clc1ccc(COc2cccc(\C=C3/NC(=O)NC3=O)c2)c(Cl)c1
Clc1ccc(COc2cccc(\C=C3/NC(=O)NC3=O)c2)cc1Cl
Clc1ccc(COc2ccc(\C=C3/NC(=O)NC3=O)cc2)c(Cl)c1
Clc1ccc(COc2ccc(\C=C3/NC(=O)NC3=O)cc2)cc1Cl
COc1ccc(COc2ccc(\C=C3/NC(=O)NC3=O)cc2)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc3cc(Br)c(cc3c2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc3cc(Br)c(cc3c2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)cc1Br
OP(O)(=O)C(F)(F)c1cc(CC(Cc2ccc3cc(Br)c(cc3c2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)ccc1Br
NS(=O)C(F)(F)c1ccc(CC(Cc2ccc3cc(Br)c(cc3c2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)cc1Br
OP(O)(=O)C(F)(F)c1cc2cc(CC(Cc3ccc(cc3)C3CC(=O)NS3(=O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
Cc1cc(CC(Cc2ccc3cc(Br)c(cc3c2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)ccc1C1CC(=O)NS1(=O)=O
OP(O)(=O)C(F)(F)c1cc2cc(CC(Cc3ccc(C4CC(=O)NS4(=O)=O)c(F)c3)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
OP(O)(=O)C(F)(F)c1cc2cc(CC(Cc3ccc4cc(Br)c(cc4c3)C(F)(F)P(O)(O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
OP(O)(=O)C(F)(F)c1cc2cc(CC(Cc3ccc4cc(Br)c(cc4n3)C(F)(F)P(O)(O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
NS(=O)C(F)(F)c1cc2cc(CC(Cc3ccc4cc(Br)c(cc4c3)C(F)(F)P(O)(O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
NS(=O)C(F)(F)c1cc2nc(CC(Cc3ccc4cc(Br)c(cc4c3)C(F)(F)P(O)(O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc3cc(Br)c(cc3n2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)cc1Br
NS(=O)C(F)(F)c1ccc(CC(Cc2ccc3cc(Br)c(cc3n2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)n2nnc3ccccc23)cc1Br
OP(O)(=O)C(F)(F)c1cc2nc(CC(Cc3ccc4cc(Br)c(cc4n3)C(F)(F)P(O)(O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
NS(=O)C(F)(F)c1cc2nc(CC(Cc3ccc4cc(Br)c(cc4n3)C(F)(F)P(O)(O)=O)(C(=O)c3ccccc3)n3nnc4ccccc34)ccc2cc1Br
OC(=O)C(=O)c1ccc(cc1)N=[N+]=[N-]
CO[C@H]1O[C@H](COCc2cn(nn2)-c2ccc(cc2)C(C)=O)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CC(=O)c1ccc(cc1)-n1cc(CO[C@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1
CO[C@H]1O[C@H](COCc2cn(nn2)-c2ccc(cc2)C(=O)OC)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](COCc2cn(nn2)-c2ccc(cc2)C(=O)C(=O)OC)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](COCc2cn(nn2)-c2ccc(cc2)C(O)=O)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](COCc2cn(nn2)-c2ccc(cc2)C(=O)C(O)=O)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
COC(=O)c1ccc(cc1)-n1cc(CO[C@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1
COC(=O)C(=O)c1ccc(cc1)-n1cc(CO[C@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1
OC(=O)c1ccc(cc1)-n1cc(CO[C@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1
OC(=O)C(=O)c1ccc(cc1)-n1cc(CO[C@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)c2ccco2)cc1)c1ccco1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)c2ccccc2)cc1)c1ccccc1
Fc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)c2ccc(F)cc2)cc1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)C2CCCCC2)cc1)C1CCCCC1
CC(C)CC(=O)Nc1ccc(cc1)-c1ccc(NC(=O)CC(C)C)cc1
CC(C)(C)OC(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)C2CCN(CC2)C(=O)OC(C)(C)C)cc1
Fc1ccc(cc1)C(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)C2CCN(CC2)C(=O)c2ccc(F)cc2)cc1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)C2CCN(CC2)C(=O)c2ccccc2)cc1)C1CCN(CC1)C(=O)c1ccccc1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)C2CCN(CC2)C(=O)c2ccco2)cc1)C1CCN(CC1)C(=O)c1ccco1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)C2CCN(CC2)C(=O)C2CCCCC2)cc1)C1CCN(CC1)C(=O)C1CCCCC1
CC(C)CC(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)C2CCN(CC2)C(=O)CC(C)C)cc1
O=C(Nc1ccccc1)c1ccc(cc1)-c1ccc(cc1)C(=O)Nc1ccccc1
COC(=O)c1ccc(cc1)-c1ccc(NC(=O)c2ccccc2)cc1
O=C(Nc1ccc(cc1)-c1ccc(cc1)C(=O)Nc1ccccc1)c1ccccc1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)c2ccco2)cn1)c1ccco1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)c2ccccc2)cn1)c1ccccc1
Fc1ccc(cc1)C(=O)Nc1ccc(cc1)-c1ccc(NC(=O)c2ccc(F)cc2)cn1
O=C(Nc1ccc(cc1)-c1ccc(NC(=O)C2CCCCC2)cn1)C1CCCCC1
CC(C)CC(=O)Nc1ccc(cc1)-c1ccc(NC(=O)CC(C)C)cn1
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@@H]1[C@H](C)OC(=O)C1=C[C@H]2CCCCCCCCCCCC |r,c:29|
CCCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@@H]1[C@H](C)OC(=O)C1=CC2CCCCCCCCCCCC |r,c:30|
CCCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@H](C(C)=O)C(=C[C@H]2CCCCCCCCCCCC)C(O)=O |r,c:27|
CCCCCCCCCCCCC\C=C\[C@]12[C@H]([C@H](C)OC1=O)[C@H](C(C)=O)C(=CC2CCCCCCCCCCCC)C(O)=O |r,c:27|
CCCCCCCCCCCC\C=C\[C@@]12[C@H]3[C@H]4C(=C[C@H]1CCCCCCCCCCCC)C(=O)O[C@@]4(C)O[C@@]3(C)OC2=O |r,c:17|
CCCCCCCCCCCC[C@@H]1C=C2[C@@H]3[C@H]4[C@](C)(OC(=O)[C@@]14C=O)O[C@]3(C)OC2=O |r,c:13|
CCCCCCCCCCCC[C@@H]1C=C2[C@@H]3[C@H]4[C@](C)(OC(=O)[C@@]14CO)O[C@]3(C)OC2=O |r,c:13|
[OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(Br)ccc1O2 |c:15|
[OH2+][V]12([OH2+])(=O)OC(=O)c3ccccc3[N]1=Cc1cc(ccc1O2)[N+]([O-])=O |c:15|
Clc1ccc2O[V]3(=O)(Oc4ccc(Cl)cc4C=[N]3c3ccccc3)[N](=Cc2c1)c1ccccc1 |c:17,27|
Brc1ccc2O[V]3(=O)(Oc4ccc(Br)cc4C=[N]3c3ccccc3)[N](=Cc2c1)c1ccccc1 |c:17,27|
[O-][N+](=O)c1ccc2O[V]3(=O)(Oc4ccc(cc4C=[N]3c3ccccc3)[N+]([O-])=O)[N](=Cc2c1)c1ccccc1 |c:18,31|
Nc1nc(Cl)c2[nH]cnc2n1
Nc1nc(Cl)c2ncn(CC#C)c2n1
Clc1nc(NCC#C)nc2n(CC#C)cnc12
CC(=O)OC[C@H]1O[C@@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)n1cc(Cn2cnc3c(Cl)nc(N)nc23)nn1
CC(=O)OC[C@H]1O[C@@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)n1cc(CNc2nc(Cl)c3ncn(Cc4cn(nn4)[C@H]4O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]4OC(C)=O)c3n2)nn1
CO[C@H]1O[C@H](Cn2cc(Cn3cnc4c(Cl)nc(N)nc34)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(Cn3cnc4c(Cl)nc(N)nc34)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(Cn3cnc4c(OC)nc(N)nc34)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(Cn3cnc4c(OC)nc(N)nc34)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(CNc3nc(Cl)c4ncn(Cc5cn(C[C@H]6O[C@H](OC)[C@H](OCc7ccccc7)[C@@H](OCc7ccccc7)[C@@H]6OCc6ccccc6)nn5)c4n3)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(CNc3nc(Cl)c4ncn(Cc5cn(C[C@H]6O[C@H](OC)[C@H](OCc7ccccc7)[C@@H](OCc7ccccc7)[C@H]6OCc6ccccc6)nn5)c4n3)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(CNc3nc(OC)c4ncn(Cc5cn(C[C@H]6O[C@H](OC)[C@H](OCc7ccccc7)[C@@H](OCc7ccccc7)[C@@H]6OCc6ccccc6)nn5)c4n3)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
CO[C@H]1O[C@H](Cn2cc(CNc3nc(OC)c4ncn(Cc5cn(C[C@H]6O[C@H](OC)[C@H](OCc7ccccc7)[C@@H](OCc7ccccc7)[C@H]6OCc6ccccc6)nn5)c4n3)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1
Oc1c(cc(c2cccnc12)S(O)(=O)=O)N=Nc1ccc2cc(ccc2c1)S(O)(=O)=O |w:16.18|
O=C(N1CCC2(CC(=NO2)c2ccccc2)CC1)c1ccc(cc1)-c1ccc(cc1)C(=O)N1CCC2(CC(=NO2)c2ccccc2)CC1 |c:7,42|
Fc1ccccc1C1=NOC2(C1)CCN(CC2)C(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)N1CCC2(CC(=NO2)c2ccccc2F)CC1 |c:43,t:8|
Fc1cccc(c1)C1=NOC2(C1)CCN(CC2)C(=O)c1ccc(cc1)-c1ccc(cc1)C(=O)N1CCC2(CC(=NO2)c2cccc(F)c2)CC1 |c:43,t:8|
CC(=O)NCCCCC(NC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(C)=O)C(N)=O
CCc1ccc(cc1)C(=O)NCCCCC(NC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(C)=O)C(N)=O
CCc1ccc(cc1)C(=O)NCCCCC(NC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)C(Cc1ccccc1)NC(C)=O)C(N)=O
CCc1ccc(cc1)C(=O)NCCCCC(NC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)C(Cc1ccccc1)NC(=O)COC1CC(C)CCC1C(C)C)C(N)=O
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccc(C)cc1
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccccc1
COc1ccc(cc1)S(=O)(=O)Oc1ccc(\C=C2/SC(=O)NC2=O)cc1OC
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1c(C)cc(C)cc1C
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(C)(=O)=O
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccc(Cl)cc1
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccc(Br)cc1
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccccc1[N+]([O-])=O
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)Cc1ccccc1
COc1cc(\C=C2/SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccc2ccccc2c1
Cc1ccc(cc1NC(=O)c2cccc(c2)NC(=O)Nc3cccc(c3)C(=O)Nc4cc(ccc4C)C(=O)Nc5ccc(c6c5c(cc(c6)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)C(=O)Nc7ccc(c8c7c(cc(c8)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O
[#8]-c1ccc(cc1)C#Cc1cccc(-c2ccc(-[#8])cc2)c1\[#6](=[#6]-1\[#6]=[#6]-[#6](=O)-[#6]=[#6]-1)-c1ccc(-[#8])cc1 |c:27,31|
[#6]-c1ccc(-c2ccc(-[#8])cc2)c(\[#6](=[#6]-2\[#6]=[#6]-[#6](=O)-[#6]=[#6]-2)-c2ccc(-[#8])cc2)c1C#Cc1ccc(-[#8])cc1 |c:16,20|
[#6]-[#8]-c1cc(ccc1-[#8])C#Cc1c(-[#6]-[#8])ccc(-c2ccc(-[#8])cc2)c1\[#6](=[#6]-1\[#6]=[#6]-[#6](=O)-[#6]=[#6]-1)-c1ccc(-[#8])cc1 |c:31,35|
[#8]-c1ccc(cc1)C#Cc1cccc(-c2ccc(-[#8])cc2-[#8])c1\[#6](=[#6]-1/[#6]=[#6]-[#6](=O)-[#6]=[#6]-1)-c1ccc(-[#8])cc1 |c:28,32|
[#8]-[#6]-c1ccc(-c2ccc(-[#8])cc2-[#8])c(\[#6](=[#6]-2/[#6]=[#6]-[#6](=O)-[#6]=[#6]-2)-c2ccc(-[#8])cc2)c1C#Cc1ccc(-[#8])cc1 |c:18,22|
OCc1ccc(-c2ccc(O)cc2)c(C(O)=O)c1C#Cc1ccc(O)cc1
COc1ccc(-c2ccc(O)cc2)c(C(c2ccc(O)cc2)c2ccc(O)cc2)c1C#Cc1ccc(O)cc1
C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)C(=O)O
OCC1O[C@H](OC(=O)c2cc(O)c(O)c(O)c2)C2OC(=O)c3cc(O)c(O)c(c3O)-c3c(O)c(O)cc(c3O)C(=O)O[C@H]2[C@@H]1O |r|
COC(=O)[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)cc2)C(O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)[C@H]1O |r|
CC(O)(CC(O)=O)CC(=O)OC[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)cc2)[C@@H](O)C(O)[C@@H]1O |r|
OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)cc2)c(O)c3=O)[C@H](O)[C@@H](O)[C@@H]1O |r|
O[C@H]1[C@H](Oc2cc(O)c3c(c2)oc(-c2ccc(O)cc2)c(O)c3=O)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O |r|
c1cc(ccc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
c1cc(ccc1C2=CC(=O)c3c(cc(cc3O2)O)O)O
c1cc(ccc1C2=CC(=O)c3c(cc(cc3O2)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O
O[C@H]1[C@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)cc2)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O |r|
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O)O)O
c1cc(c(cc1C2=C(C(=O)c3c(cc(cc3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O
OC[C@H]1O[C@@H](Oc2cc(ccc2O)-c2oc3cc(O)cc(O)c3c(=O)c2O)[C@H](O)[C@@H](O)[C@@H]1O |r|
OC[C@H]1O[C@@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O |r|
O[C@H]1[C@H](Oc2cc(O)c3c(c2)oc(cc3=O)-c2ccc(O)c(O)c2)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O |r|
O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)OCOc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |r|
O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)OCCCCOc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(O)c(O)c1 |r|
OC[C@H]1O[C@@H](Oc2cc(ccc2O)-c2cc(=O)c3c(O)cc(O)cc3o2)[C@H](O)[C@@H](O)[C@@H]1O |r|
c1c2c-3c(c(c1O)O)OC(=O)c4c3c(c(c(c4)O)O)OC2=O
COc1cc(CCCO)cc2C(CO)C(Oc12)c1ccc(O[C@@H]2OC(CO)[C@@H](O)C(O)[C@@H]2O)c(OC)c1 |r|
COc1cc(CC(=O)NCC(NC(=O)C(CCCNC(=O)c2cccc(I)c2)NC(=O)C(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)NC(=O)c2ccc(C)c(Br)c2)C(N)=O)ccc1O
CC(=O)NC(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)NC(CCCNC(=O)c1cccc(I)c1)C(N)=O
Cc1ccc(cc1Br)C(=O)NC(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)NC(CCCNC(=O)c1cccc(I)c1)C(N)=O
Oc1cc(cc2c(cccc12)\N=N\c1cccc2c(O)cc(cc12)S(O)(=O)=O)S(O)(=O)=O
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1F
Oc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(F)c1
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(F)cc1
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1Cl
Oc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(Cl)c1
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(Cl)cc1
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(Cl)cc1Cl
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1Br
Oc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(Br)c1
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccc(Br)cc1
Oc1cc(O)c2C(=O)CC(Oc2c1)c1cccc(c1)C(F)(F)F
Oc1cc(O)c2C(=O)CC(Oc2c1)c1ccccc1
Cc1ccc(cc1)C1CC(=O)c2c(O)cc(O)cc2O1
COc1ccc(cc1)C1CC(=O)c2c(O)cc(O)cc2O1
[H][C@@]12[C@@H](C)[C@H](C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)C3CC[C@@]12C)C(O)=O |r,t:15|
Cn1c(c(I)c2cc(C(O)=O)c(O)cc12)-c1cccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccsc2)c1
c1ccc(cc1)NC(=O)C(=O)O
OC(=O)C(=O)Nc1ccc(cc1)C#C
CC(C)(C)OC(=O)NCC#Cc1ccc(NC(=O)C(O)=O)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccccc1
OC(=O)C(=O)Nc1cccc(c1)C#Cc1ccccc1
OC(=O)C(=O)Nc1ccc(cc1)-c1ccccc1
OC(=O)C(=O)Nc1cccc(c1)-c1ccccc1
OC(=O)C(=O)Nc1cnc2ccccc2c1
COC(=O)c1ccc(cc1)C#Cc1ccc(NC(=O)C(O)=O)cc1
COC(=O)c1cc(ccc1O)C#Cc1ccc(NC(=O)C(O)=O)cc1
COC(=O)c1ccc(cc1O)C#Cc1ccc(NC(=O)C(O)=O)cc1
COC(=O)c1cc(C#Cc2ccc(NC(=O)C(O)=O)cc2)c(cc1O)N(C)C
COC(=O)c1cc(C#Cc2cccc(NC(=O)C(O)=O)c2)c(cc1O)N(C)C
CN(C)c1cc(O)c(cc1C#Cc1ccc(NC(=O)C(O)=O)cc1)C(O)=O
CN(C)c1cc(O)c(cc1C#Cc1cccc(NC(=O)C(O)=O)c1)C(O)=O
CC(C)(C)c1ccc(cc1)C#Cc1ccc(NC(=O)C(O)=O)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(OC(F)(F)F)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1cccc(c1)C(F)(F)F
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1)C(F)(F)F
NS(=O)(=O)c1ccc(cc1)C#Cc1ccc(NC(=O)C(O)=O)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(O)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(O)c(Br)c1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1)C#N
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc2ccccc2c1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(OCc2ccccc2)cc1
CC(C)(C)OC(=O)Nc1ccc(cc1)C#Cc1ccc(NC(=O)C(O)=O)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1Cl)C(F)(F)F
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1Br)C(F)(F)F
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1F)C(F)(F)F
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1C#N)C(F)(F)F
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1C(F)(F)F)C(F)(F)F
OC(=O)C(=O)Nc1ccc(\C=C/c2ccccc2)cc1
OC(=O)C(=O)Nc1ccc(\C=C/c2ccc(cc2)C(F)(F)F)cc1
OC(=O)C(=O)Nc1ccc(CCc2ccccc2)cc1
OC(=O)C(=O)Nc1ccc(CCc2ccc(cc2)C(F)(F)F)cc1
CCCCCCCCCOc1ccc(cc1C(O)=O)-c1ccc(CC(O)=O)cc1
CCCCCCCCCOc1ccc(-c2ccc(CC(O)=O)cc2)c(c1)C(O)=O
CC(C)CNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CC(C)CNC[C@@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CC(C)CNCC1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2CCCC2)O3)S(=O)(=O)N1
CC(C)(CO)CCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CC(C)(O)CCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2CC(F)(F)C2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCCC(F)F)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2CCOC2)O3)S(=O)(=O)N1
CCCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CCCN(CCC)C[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CCCCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCCC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCOCC2)O3)S(=O)(=O)N1
CC(C)CCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
CCC(C)CNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)O1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CN(CC2CC2)CC2CC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2COC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2(CO)CCC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2(CO)CCCC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCCOCC(F)F)O3)S(=O)(=O)N1
CC(C)(C)OC(=O)N1CCC(CNC[C@H]2Cc3c(cc(O)c(N4CC(=O)NS4(=O)=O)c3F)O2)CC1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2CCOCC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2C4CCCC42)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCCc2ccccc2)O3)S(=O)(=O)N1
CC1=C(CCNC[C@H]2Cc3c(cc(O)c(N4CC(=O)NS4(=O)=O)c3F)O2)C(C)(C)CCC1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CC(c4ccccc4)C2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCC(C(F)(F)F)CC2)O3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2(CF)CC2)O3)S(=O)(=O)N1
CC(C)CNC[C@@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CC(C)CNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CCC(CC)CNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CCCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
COCCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCC2)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCOCC2)N3)S(=O)(=O)N1
CC(C)CCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC(F)F)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC(F)(F)F)N3)S(=O)(=O)N1
CCC(C)CNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CC(F)(F)C2)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)CC(CNCCC2COC2)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)CC(CNCCCC(F)F)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CCCC2)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC2CC2)N3)S(=O)(=O)N1
CCCC(C)NC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CC[C@@H](C)NC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CCCCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CO)N3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCCC2CC2)N3)S(=O)(=O)N1
CC(C)(C)CCNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CC(C)C1CC(CNC[C@H]2Cc3c(cc(O)c(N4CC(=O)NS4(=O)=O)c3F)N2)C1
CC(C)CN(C)C[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1
CC(C)CNC[C@H]1Cc2c(cc(O)c(N3CC(=O)NS3(=O)=O)c2F)N1C
O=C1CN(c2c(O)cc3c(c2F)C[C@H](CNCC(O)C(F)F)N3)S(=O)(=O)N1
N/N=C(N)c1cc(-c2ccc(/C=C3Sc4ccccc4C3=O)o2)ccc1O
Nc1ccc(NC(=O)c2cc(-c3ccc(/C=C4Sc5ccccc5C4=O)o3)ccc2O)cc1
O=C(Nc1ccccc1)c1cc(-c2ccc(/C=C3Sc4ccccc4C3=O)o2)ccc1O
O=C1CCC/C1=Cc1ccc(-c2ccc(O)c(C(=O)Nc3ccccc3)c2)o1
N#Cc1cc(-c2ccc(/C=C3Sc4ccccc4C3=O)o2)ccc1O
O=C(Nc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc1c(C(F)(F)P(=O)(O)O)sc2ccc(C(=O)Nc3ccccc3)cc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2ccc(C(=O)NC3CC(F)(F)C3)cc12
COc1cccc(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(C#N)c3c2)c1
N#CCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(C#N)c2c1
COCCN(CCOC)C(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc1cccc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
O=C(Nc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(C(F)(F)F)c2c1
O=C(NCc1cccnn1)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC(c1ccccc1F)C(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@@H]1CCC[C@H]1OCc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@H]1Cc2ccc(F)cc21)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCC1CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccc(OCC2CCCO2)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccc(OC(F)(F)F)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ncc(C2CCC2)o1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CN(C(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccc(Oc2ccccc2)c1
N#CC4(c3ccc(NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)cc3)CCCCC4
O=C(NCc1cnn2ccccc12)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccnc1Oc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1cccc(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)c1
O=C(Nc1ccc(F)cc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccc(OCC2CCCO2)cc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CC(F)(F)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCC1CC(F)(F)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ccc(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)cc1
O=C(NCc1cncc(C(F)(F)F)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccccc1F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccc(F)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CCCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccnc1
O=C(NC1CCC(F)(F)CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CC1CCC(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)C1
N#CC1(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)CC1
O=C(NC1CC1(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COC1CC(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)C1
O=C(NC1CCC(F)(F)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cncnc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1noc(C)c1CCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)N1CCC(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)CC1
COCCCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CCCCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCCC(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)N1CC2(CC(NC(=O)c3ccc4sc(C(F)(F)P(=O)(O)O)c(Br)c4c3)C2)C1
O=C(NCC(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1nn(C)cc1CNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1nnc2n1CCC2)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@H]1CC[C@H](C(F)(F)F)CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCC1CCCCC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@H]1CC[C@@H](C(F)(F)F)CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)CNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CCS(=O)(=O)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@@H]1[C@@H]2COC[C@@H]21)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CN1CCCC(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)C1
O=C(NCCC1CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)OCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccc(-c2cnco2)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccccc1-c1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC1CCc2c(sc(NC(=O)c3ccc4sc(C(F)(F)P(=O)(O)O)c(Br)c4c3)c2C#N)C1
O=C(Nc1ccc(Cn2cccn2)cc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC(c1ccccc1)c1cccnc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc1cccc(-c2cccc(NC(=O)c3ccc4sc(C(F)(F)P(=O)(O)O)c(Br)c4c3)c2)c1
O=C(NC1CCN(Cc2ccccc2)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CCCN(Cc2ccccc2F)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
C[C@@H](Cc1cccc(C(F)(F)F)c1)NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1ncn(-c2ccccc2)n1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccc2ccccc12
O=C(NCCc1cnc2n(c1=O)CCCC2)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1cc(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)n(Cc2ccccc2)n1
CC(=O)N1CCC(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)(C(F)(F)F)C1
O=C(N[C@@H]1CCCC[C@H]1OCc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CCCN(c2ccccc2)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(=O)N1CCc2ccc(NC(=O)c3ccc4sc(C(F)(F)P(=O)(O)O)c(Br)c4c3)cc21
CN1C[C@H]2[C@H](CNC(=O)c3ccc4sc(C(F)(F)P(=O)(O)O)c(Br)c4c3)[C@H]2c2ccccc21
O=C(N[C@H]1CC(=O)N(C2CC2)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1ccc2c(c1)OCCO2
CC(Cn1ccc2ccccc21)NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCc1nc(-c2ccccc2)cs1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc1ccc2c(c1)CC(NC(=O)c1ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c1)C2
CCC(COCc1ccccc1)NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CCN1C(=O)CCC12C[C@H]2CCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@@H]1CCCC[C@H]1c1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ccc(CCC(C)NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)cc1
O=C(NC[C@]12C[C@@H]1CCN2Cc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCn1nnc2ccccc21)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1ccccc1N1CCOCC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1nccc(-c2cccnc2)n1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)(O)c1ccc(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)cn1
CC(C)C1CC(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)C1
O=C(NCCc1c[nH]c2ccc(F)cc12)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1cccc(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)c1OC(F)F
Cn1cc(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)cn1
O=C(N[C@H]1CCCNC1=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC1CCCC(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)C1
CCn1nccc1NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccc(Sc2ccccc2)nc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccc(OC(F)(F)F)c1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cnccn1
O=C(Nc1cccc(CO)n1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CCC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1nccs1
Cc1c(NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)cccc1C(=O)N1CCCC1
COCCOc1cc(C)ccc1NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccccc1OC1CCOCC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1cccc(-n2nccn2)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1COc2ccccc2C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1(c2cncc(C(F)(F)F)c2)CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COCC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1ccc(F)cc1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1ccccc1-n1cccn1
O=C(NCC1CCCN(c2ncccn2)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1(c2cccc(F)c2)CCCC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(N[C@H]1CCN(C(=O)C2CC2)C1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC(c1ccc(F)cc1)C(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1cc(C)n(-c2ccccc2NC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)n1
O=C(NCc1cnc2[nH]ccc2c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnc1C(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1ccc(C(F)(F)F)nc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ncccc1CNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cnccn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1nn(C)c(C)c1CNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COCCCNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCC1CNC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CCCOC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CCS(=O)(=O)CC1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1c[nH]c(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)c(C)c1=O
C[C@@H](NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccnn1
O=C1NC[C@@H](CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)N1
O=C1NC[C@H](CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)N1
O=C(NCc1ccc(F)nc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1ccc[n+]([O-])c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cncc(F)c1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C1CCC(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)N1
Cc1ccc(CNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)nn1
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cncnc1
O=C(NCc1ncn[nH]1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1c[nH]nn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cn1cncc1CNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cn2ccccc2n1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCn1cnnc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCn1cccn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(Cn1cncn1)NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCn1cncn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCn1ccnn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(Cn1ccnc1)NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1cnn(CCNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)c1
O=C(NCCn1nncc1-c1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(CC1C=Nc2ccc(F)cc21)NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ccc2c(c1)C(CC(C)NC(=O)c1ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c1)C=N2
O=C(NCCc1c[nH]c2ccccc12)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ccc2[nH]cc(CCNC(=O)c3ccc4sc(C(F)(F)P(=O)(O)O)c(Br)c4c3)c2c1
Cn1cc(CCNC(=O)c2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)c2ccccc21
O=C(NCCn1ccc2ccccc21)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCCSC(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC(c1cccnc1)C(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1c[nH]nn1)c1cc(Cl)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(Cl)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc2cc(C(=O)NCc1cccnn1)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23
N#Cc2cc(C(=O)NCc1c[nH]nn1)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23
COc2cc(C(=O)NCc1cccnn1)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23
O=C(NCc1cccnn1)c1cc(F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1c[nH]nn1)c1cc(F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1c[nH]nn1)c1cc(O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)(O)CCOc1cc(C(=O)NCc2cccnn2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CC(C)(O)CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2ccc(C(=O)NCc3ncn[nH]3)cc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2ccc(C(=O)NCc3cccnn3)cc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2ccc(C(=O)NCc3c[nH]nn3)cc12
O=C(NCc1ncc[nH]1)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
CC(NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3nncn3C
C[C@@H](NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3ccnn3C
CCC(NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3cccnc3
Cn3cnc(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3
O=C(NCc1ccon1)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
O=C(NC2(c1cccnc1)CC2)c4ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c4
Cn3cnc(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)n3
C[C@@H](NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3ncc(F)cn3
Cc3cnc(F)c(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3
O=C(NCc1ncc(F)cn1)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
C[C@H](NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3ccccn3
C[C@@H](NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(C#N)c2c1)c1cccnn1
O=C(NCc1n[nH]c(=O)[nH]1)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
O=C(NCc1cnsn1)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
O=C(NCc2cc(C1CC1)on2)c4ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c4
Cc3cc(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)no3
CCC(NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3ncnn3C
O=C(NC(CO)c1ccccn1)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
Cn1nncc1CNC(=O)c3ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
CC(NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3ccon3
CCc3nc(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)no3
CCc3noc(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)n3
CCC(NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3ccccn3
Cc3c[nH]c(CNC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)n3
C[C@@H](NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3cccnc3
C[C@H](NC(=O)c2ccc1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2)c3cccnc3
O=C(NCc1cc[nH]n1)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cc[nH]n1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CN(C)C(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccccc1)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CC(F)(F)C1)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC1CC1(F)F)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
C[C@@H](NC(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccnn1
O=C(NCc1c[nH]nn1)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
C=C(C)C#Cc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CN(C)CCNC(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1ccc(F)cc1
O=C(Nc1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)C(F)(F)F
O=C(Cc1cccnc1)Nc1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Cl)c2c1
O=C(Nc1ccccc1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(C(F)F)c2c1
Cc1[nH]cnc1CNC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1c[nH]cn1)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(Nc1ccccc1)Nc1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1cccc(NCc2ccc3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)c1
O=P(O)(O)C(F)(F)c1sc2ccc(OCCc3ccccc3)cc2c1Br
O=C(NC(c1cccnc1)C(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NC(c1ccncc1)C(F)(F)F)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(NCCC3CCCCC3)cccc2c1Br
CC(C)(O)CCCNc1cccc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CC(NC(=O)c1ccc2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)c1cccnn1
O=P(O)(O)C(F)(F)c1sc2c(NCCCC(F)(F)F)cccc2c1Br
O=P(O)(O)C(F)(F)c1sc2ccc(-c3nnc[nH]3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2ccc(-c3ncc[nH]3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2ccc(-c3ncn[nH]3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2ccc(-c3nc4ccccc4[nH]3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)c(F)ccc2c1Br
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3nc[nH]n3)cc2c1Br
N#Cc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COC(C)(C)C#Cc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(OCCCC2CC2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCOCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CCCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
N#CCCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCc2ccccc2F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CCCCCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
N#CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)COc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCc2cc(F)cc(C(F)(F)F)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)N1CCC(Oc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)C1
NC(=O)c1cc(OCC2CC3(CC3)C2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CC2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCOCC(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCCOC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CCC(F)(F)CC2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCC2CC2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)NCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCC(=O)Nc2c(F)cccc2F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3cnn[nH]3)cc2c1Br
Nc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3ccn[nH]3)cc2c1Br
NC(c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1)C(F)(F)F
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3cnn[nH]3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(CN3CCOCC3)cc2c1Br
NC(=O)c1cc(OCCC2CCCS2(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(OCCCCn2ccnc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(OCCCc2cccnc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(OCCCc2ccncc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=C(NCc1cccnn1)c1cc(OCCCc2cncs2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCCc2cncs2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCCC(F)(F)C(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CCOCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CC(F)(F)C2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CC3(C2)CC(F)(F)C3)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
C[C@@H]1C[C@@]1(F)COc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CC(C)(C#N)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OC[C@@H]2CC[C@H]2C(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CC(OC(F)(F)F)C2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(F)(F)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCC[C@@H]2C[C@H]2C(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC12CC(COc3cc(C(N)=O)cc4c(Br)c(C(F)(F)P(=O)(O)O)sc34)(C1)C2
NC(=O)c1cc(OCC2CC3(CCC3)C2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCCCC(F)(F)C(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCC2CC2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2C3CC4C(C3)C24)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CC1(c2ccc(COc3cc(C(N)=O)cc4c(Br)c(C(F)(F)P(=O)(O)O)sc34)cc2)CC1
CC[C@@H]1C[C@H]1COc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCC23COC(CF)(C2)C3)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCC(F)(F)C(F)(F)C(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC1(C)CC(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)C1
NC(=O)c1cc(OCCC23CC(C2)C3)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2C(F)(F)C23CCC3)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CC(C3CC3)C2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc1ccc2cc(C(F)(F)P(=O)(O)O)sc2c1Br
O=P(O)(O)C(F)(F)c1sc2cc(Br)ccc2c1Br
N#Cc1ccc2c(Br)c(C(F)(F)P(=O)(O)O)sc2c1
NC(=O)c1ccc2c(Br)c(C(F)(F)P(=O)(O)O)sc2c1
N#Cc1ccc2c(C#N)c(C(F)(F)P(=O)(O)O)sc2c1
CC(C)(O)CCOc1ccc2c(Br)c(C(F)(F)P(=O)(O)O)sc2c1
O=C(Nc1ccc2c(Br)c(C(F)(F)P(=O)(O)O)sc2c1)c1ccccc1
[2H]C([2H])([2H])NC(=O)c1cc(OCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CCNC(=O)c1cc(OCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(C)(O)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CC(C)=CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(C#CCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(CCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(NCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(CCc2ccccc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
C[Si](C)(C)CCc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCC2CC2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC2CC2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCC2CCC2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)CCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CNC(=O)c1cc(OCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCC2CC2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCC2CC2(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCCNS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCC(C)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CNC(=O)c1cc(OCCCC(C)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(F)(F)CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
N#CCCNC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CCCNC(=O)c1cc(OCCCC)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#CCCNC(=O)c1cc(OCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCCC2(O)CC2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CCC(=O)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CS(=O)(=O)CCCOc1cc(C(N)=O)cc2c(Cl)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c2cc(OCCCNS(=O)(=O)C(F)(F)F)c1sc(C(F)(F)P(=O)(O)O)c(Br)c1c2
NC(=O)c1cc(OCCCC2(S(N)(=O)=O)CC2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(F)cc2C(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)c(C)c1
NC(=O)c1cc(OCc2ccc(C(F)(F)F)cc2F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(OC(F)(F)F)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(C(F)(F)F)cc2C(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
N#Cc1cc(Cl)ccc1COc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCc2ccc(F)cc2OC(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-c3ncccn3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1C(F)(F)F
NC(=O)c1cc(OCc2ccc(C(F)(F)F)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-c3ccccc3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(Cl)c(Cl)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)c(C(F)(F)F)c1
COc1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1F
NC(=O)c1cc(OCc2ccc(C3CCN(CC(F)(F)F)CC3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(F)c(C(F)(F)F)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1cc(C)c(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)c(C)c1
NC(=O)c1cc(OCc2ccc(-n3cncn3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-c3nccs3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-n3ccnc3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(F)c(F)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(C(F)(F)F)c(F)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1C
CC(C)(C)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1
NC(=O)c1cc(OCc2ccc(OC(F)F)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1C(F)(F)F
COc1cc(Cl)ccc1COc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
COc1cc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)ccc1C#N
CS(=O)(=O)CCCOc1cc(-c2cnn[nH]2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NS(=O)(=O)CCCOc1cc(-c2cnn[nH]2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
Cc1nn[nH]c1c3cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
O=P(O)(O)C(F)(F)c1sc2c(OCC3CC3(F)F)cc(-c3cnn[nH]3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2c(OCC3CC3(F)F)cc(-c3cnn[nH]3)cc2c1Br
CS(=O)(=O)c1ccc(COc2cc(-c3cnn[nH]3)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1
CCCC(C)Oc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCc2cc(F)cc(C(F)(F)F)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)N1CCC(Oc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)C1
CNS(=O)(=O)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CN(C)S(=O)(=O)CCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)CCCCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCc2ccc(CS(N)(=O)=O)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1
NC(=O)c1cc(OC[C@@H]2C[C@@H]2F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cn1
NC(=O)c1cc(OCc2ccc(S(N)(=O)=O)nc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OC[C@H]2C[C@H](S(N)(=O)=O)C2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OC[C@H]2C[C@@H](S(N)(=O)=O)C2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2cccc(C(F)(F)F)c2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c3cc(OCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c3
NC(=O)c1cc(OCc2cccc3ccccc23)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc3c(c2)CCS3(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)c(Cl)c1
NC(=O)c1cc(OCc2ccc(C3(C(F)(F)F)CC3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)c(F)c1
CS(=O)(=O)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1Cl
Cc1cc(S(C)(=O)=O)ccc1COc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CC1CCS(=O)(=O)C1CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
CCC(=O)c1cc(OCCCC(C)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(F)(F)CCOc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
N#CCCCC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC1(c2ccc(COc3cc(C(N)=O)cc4c(Br)c(C(F)(F)P(=O)(O)O)sc34)cc2)CC1
NC(=O)c1cc(OCc2ccc(S(N)(=O)=O)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-c3cncnc3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(C3CC3)cc2Cl)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc([C@H]3CC[C@H](C(F)(F)F)CC3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-c3cccnc3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCc2ccc(-c3ccncc3)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCC23CC(S(N)(=O)=O)(C2)C3)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3cn[nH]c3)cc2c1Br
C#Cc1cc(OCCCC)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(I)cc2c1Br
O=C(O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(CO)cc2c1Br
CNC(=O)c1cc(OCc2ccc(S(C)(=O)=O)cc2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cccc2c1Br
CS(=N)(=O)Cc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=N)(=O)Cc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=N)(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=N)(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(-c2cc[nH]n2)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3c[nH]cn3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2c(OCCCC(F)(F)F)cc(-c3nnc(C4CC4)[nH]3)cc2c1Br
Cc1nnc(-c2cc(OCCCC(F)(F)F)c3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)[nH]1
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(=O)(=O)C(F)(F)F)cc(C(N)=O)cc12
CNC(=O)c1cc(OCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(C#N)c2c1
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(N)(=O)=O)cc(C(N)=O)cc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCC(F)(F)F)cc(C(N)=O)cc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCC3CC3(F)F)cc(C(N)=O)cc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCC3CC3(F)F)cc(C(N)=O)cc12
CNC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(C#N)c2c1
CS(=O)(=O)CCCOc1cc(-c2nc[nH]n2)cc2c(C#N)c(C(F)(F)P(=O)(O)O)sc12
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(C)(=O)=O)cc(C(N)=O)cc12
CNC(=O)c1cc(OCCCS(C)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(C)c2c1
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCC(F)(F)F)cc(C(N)=O)cc12
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(N)(=O)=O)cc(C(N)=O)cc12
CNC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(C)c2c1
CCCCOc1cc(C2=C(C)N=NC2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
O=P(O)(O)C(F)(F)c1sc2c(OCC3CC3(F)F)cc(C3=CN=NC3)cc2c1Br
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(C)(=O)=O)cc(-c3nc[nH]n3)cc12
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCC(C)(C)O)cc(C(N)=O)cc12
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCc3ccc(S(C)(=O)=O)cc3)cc(C(N)=O)cc12
CS(=O)(=O)CCCOc1cc(-c2nc[nH]n2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NS(=O)(=O)CCCOc1cc(-c2nc[nH]n2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
O=P(O)(O)C(F)(F)c1sc2c(OCC3CC3(F)F)cc(-c3nc[nH]n3)cc2c1Br
O=P(O)(O)C(F)(F)c1sc2c(OCC3CC3(F)F)cc(-c3nc[nH]n3)cc2c1Br
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(N)(=O)=O)cc(-c3nc[nH]n3)cc12
CS(=O)(=O)c1ccc(COc2cc(-c3nc[nH]n3)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)cc1
CS(=O)(=O)CCCOc1cc(C(N)=O)cc2c(C(F)(F)F)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCCS(N)(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(C(F)(F)F)c2c1
CCCC(CO)Oc1cc(C(N)=O)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
N#CCc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CC(=O)NCc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)NCc1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(C)(=O)=O)cc(-c3c[nH]nn3)cc12
Cc1ncc(-c2cc(OCCCC(F)(F)F)c3sc(C(F)(F)P(=O)(O)O)c(Br)c3c2)[nH]1
CS(=O)(=O)CCCOc1cc(C(N)=O)cc2cc(C(F)(F)P(=O)(O)O)sc12
CS(=O)(=O)CCCOc1cc(C(N)=O)cc2c(C(F)F)c(C(F)(F)P(=O)(O)O)sc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(N)(=O)=O)cc(-c3c[nH]nn3)cc12
CC(C)(O)CCCOc1cc(C(N)=O)cc2c(C(F)(F)F)c(C(F)(F)P(=O)(O)O)sc12
N#Cc1c(C(F)(F)P(=O)(O)O)sc2c(OCCCS(N)(=O)=O)cc(-c3nc[nH]n3)cc12
CS(=O)(=O)CCCOc1cc(C(N)=O)cc2c(C3CC3)c(C(F)(F)P(=O)(O)O)sc12
CNS(=O)(=O)c1cc(OCCCC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)CCCOc1cc(-c2cc(=O)cc[nH]2)cc2c(Br)c(C(F)(F)P(=O)(O)O)sc12
NC(=O)c1cc(OCCC2CCNS2(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
NC(=O)c1cc(OCCC2CCNS2(=O)=O)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
CS(=O)(=O)c1ccc(COc2cc(C(N)=O)cc3c(Br)c(C(F)(F)P(=O)(O)O)sc23)c(C#N)c1
NC(=O)c1cc(OCC(F)CC(F)(F)F)c2sc(C(F)(F)P(=O)(O)O)c(Br)c2c1
COc1cc(cc(Br)c1OC)C(=O)O[C@@H]1COC(OC(=O)c2cc(Br)c(OC)c(OC)c2)[C@H](OC(=O)c2cc(Br)c(OC)c(OC)c2)[C@H]1OC(=O)c1cc(Br)c(OC)c(OC)c1 |r|
COc1cc(cc(Br)c1OC)C(=O)OCC(COC(=O)c1cc(Br)c(OC)c(OC)c1)OC(=O)c1cc(Br)c(OC)c(OC)c1
COc1cc(cc(Br)c1O)C(=O)O[C@@H]1CO[C@@H](OC(=O)c2cc(Br)c(O)c(OC)c2)[C@H](OC(=O)c2cc(Br)c(O)c(OC)c2)[C@H]1OC(=O)c1cc(Br)c(O)c(OC)c1 |r|
COc1cc(cc(Br)c1O)C(=O)OC[C@H]1OC(OC(=O)c2cc(Br)c(O)c(OC)c2)[C@H](OC(=O)c2cc(Br)c(O)c(OC)c2)[C@@H]1OC(=O)c1cc(Br)c(O)c(OC)c1 |r|
COc1cc(cc(Br)c1O)C(=O)OCC(COC(=O)c1cc(Br)c(O)c(OC)c1)OC(=O)c1cc(Br)c(O)c(OC)c1
Oc1cc(cc(Br)c1O)C(=O)O[C@@H]1CO[C@@H](OC(=O)c2cc(O)c(O)c(Br)c2)[C@H](OC(=O)c2cc(O)c(O)c(Br)c2)[C@H]1OC(=O)c1cc(O)c(O)c(Br)c1 |r|
Oc1cc(cc(Br)c1O)C(=O)OC[C@H]1OC(OC(=O)c2cc(O)c(O)c(Br)c2)[C@H](OC(=O)c2cc(O)c(O)c(Br)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(Br)c1 |r|
c1ccc(cc1)[C@@H](Cc2ccc(c(c2)Br)C(F)(F)P(=O)(O)O)C(=O)c3ccccc3
CCc1cc(C[C@H](NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
Oc1ccc(cc1O)C(=O)O[C@@H]1COC(OC(=O)c2ccc(O)c(O)c2)[C@H](OC(=O)c2ccc(O)c(O)c2)[C@H]1OC(=O)c1ccc(O)c(O)c1 |r|
Oc1ccc(cc1O)C(=O)OC[C@H]1OC(OC(=O)c2ccc(O)c(O)c2)[C@H](OC(=O)c2ccc(O)c(O)c2)[C@@H]1OC(=O)c1ccc(O)c(O)c1 |r|
Oc1ccc(cc1O)C(=O)OCC(COC(=O)c1ccc(O)c(O)c1)OC(=O)c1ccc(O)c(O)c1
Oc1ccc(cc1O)C(=O)OCCOC(=O)c1ccc(O)c(O)c1
COc1cc(cc(Br)c1OC)C(=O)OC[C@H]1OC(OC(=O)c2cc(Br)c(OC)c(OC)c2)[C@H](OC(=O)c2cc(Br)c(OC)c(OC)c2)[C@@H]1OC(=O)c1cc(Br)c(OC)c(OC)c1 |r|
COc1cc(cc(Br)c1OC)C(=O)OCCOC(=O)c1cc(Br)c(OC)c(OC)c1
COc1cc(cc(Br)c1O)C(=O)OCCOC(=O)c1cc(Br)c(O)c(OC)c1
Oc1cc(cc(Br)c1O)C(=O)OCC(COC(=O)c1cc(O)c(O)c(Br)c1)OC(=O)c1cc(O)c(O)c(Br)c1
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2Oc3cc(c4c(c3)O[C@@H](CC4=O)c5ccc(cc5)O)O)CO)O)O)O)O)O
OC[C@H]1O[C@@H](Oc2cc(O)c3C(=O)C[C@H](Oc3c2)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Oc1ccc(cc1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4C(=O)C[C@H](Oc4c3)c3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |r|
OP(O)(=O)C(F)(c1ccc(cc1)-c1cccc(Cc2cc(Cl)c(Cl)cc2Cl)c1F)S(=O)(=O)N1CCOCC1
CC1(N)CCN(CC1)c1nc(cs1)-c1ccc2cc(Br)ccc2c1
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(\[#6]=[#6]\[#6](=O)-c2ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2-[#8])ccc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1coc2c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc(-[#8])c2c1=O
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(c1-[#8])-c1coc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc(-[#8])c2c1=O
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc(ccc1-[#8])-c1cc(=O)c2c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2o1
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6@H]-2-[#6]-[#8]-c3cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c3-[#6]-2=O)c1-[#8] |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2-[#8]-1
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8]-1 |r|
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc(\[#6]=[#6]\[#6](=O)-c2ccc(-[#8])cc2-[#8])ccc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc2occ(-c3cc(-[#8])c4-[#8]C([#6])([#6])[#6]=[#6]-c4c3)c(=O)c2c1-[#8] |c:22|
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc(cc2)C(F)(F)F)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc(F)c(Cl)n2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ncc(Cl)cc2Br)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc(cc2Br)C(F)(F)F)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc(nc2)C(F)(F)F)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc(OC)nc2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)Cc2c(Cl)cccc2Cl)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2cccs2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2cc(I)ccc2F)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2cccc(OC(F)(F)F)c2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2cccc(I)c2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc(nc2)C#N)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccccn2)cc1
COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2cccc(c2)C(F)(F)F)cc1
[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]1([#6])[#8]-c2c(-[#6]\[#6]=[#6](\[#6])-[#6])c3-[#8][C@@]45[#6@H]6-[#6]-[#6@@H](-[#6]=[#6]4-[#6](=O)-c3c(-[#8])c2-[#6]=[#6]1)-[#6](=O)[C@]5([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)[#8]C6([#6])[#6] |r,c:22,33,TLB:22:21:18:42.43,THB:33:32:18:42.43,43:19:23.22:34.32|
[H][C@@]12[#6][C@@]3([H])[#6@H](-[#8]-[#6])-[#6]4-[#6](=O)-c5c(-[#8])c6-[#6]=[#6]C([#6])([#6])[#8]-c6c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)([#8]C2([#6])[#6])[#6]3=O |r,c:15,TLB:6:5:31.43:2.1,44:43:8.5:2.1,THB:40:1:31.43:8.5,9:8:31.43:2.1,32:31:8.5:2.1|
[H][C@@]12[#6][C@@]3([H])[#6](-[#8]-[#6])=[#6]4-[#6](=O)-c5c(-[#8])c6-[#6]=[#6][C@@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#8]-c6c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](/[#6])-[#6])([#8]C2([#6])[#6])[#6]3=O |r,c:15,t:7,TLB:5:3:43.42:35,34:35:2.3.46:43.42,37:36:1.2:8.5,9:8:1.2:46.36,THB:47:46:43.42:35,47:46:1.2:8.5,43:1:46.36:8.5,6:5:1.2:46.36,8:35:2.3.46:43.42|
[H][C@@]12[#6][C@@]3([H])[#6@H](-[#8]-[#6])-[#6]4-[#6](=O)-c5c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)([#8]C2([#6])[#6])[#6]3=O |r,TLB:34:35:2.3.48:45.44,9:8:1.2:48.36,5:3:45.44:35,37:36:1.2:8.5,THB:6:5:1.2:48.36,45:1:48.36:8.5,8:35:2.3.48:45.44,49:48:45.44:35,49:48:1.2:8.5|
[H][C@@]12[#6][C@@]3([H])[#6]=[#6]4-[#6](=O)-c5c(-[#8])c6-[#6]=[#6]C([#6])([#6])[#8]-c6c(-[#6]\[#6]=[#6](/[#6])-[#6])c5-[#8][C@@]14[C@]([#8]C2([#6])[#6])(\[#6]=[#6](\[#6])-[#6](-[#8])=O)[#6]3=O |r,c:13,t:5,TLB:27:28:30.31:40.3.2,30:29:6.5:1.2,41:40:6.5:1.2,5:3:28:30.31,THB:31:1:6.5:29.40,7:6:29.40:1.2,41:40:28:30.31,34:29:6.5:1.2|
[H][C@@]12[#6][C@@]3([H])[#6]=[#6]4-[#6](=O)-c5c(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)([#8]C2([#6])[#6])[#6]3=O |r,t:5,TLB:47:46:6.5:1.2,32:33:42.43:46.3.2,42:34:6.5:1.2,5:3:33:42.43,THB:47:46:33:42.43,7:6:34.46:1.2,43:1:6.5:34.46|
[H][C@@]12[#6][C@@]3([H])[#6]=[#6]4-[#6](=O)-c5c(-[#8])c6-[#6]=[#6]C([#6])([#6])[#8]-c6c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](/[#6])-[#6])([#8]C2([#6])[#6])[#6]3=O |r,c:13,t:5,TLB:5:3:36.35:28,27:28:2.3.39:36.35,30:29:1.2:6.5,7:6:1.2:39.29,THB:40:39:36.35:28,40:39:1.2:6.5,36:1:39.29:6.5,6:28:2.3.39:36.35|
[H][C@@]12[#6][C@@]3([H])[#6@H](-[#8]-[#6])-[#6]4-[#6](=O)-c5c(-[#8])c6-[#6]=[#6][C@@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#8]-c6c(-[#6]\[#6]=[#6](\[#6])-[#6])c5-[#8][C@@]14[C@@]([#6]\[#6]=[#6](\[#6])-[#6](-[#8])=O)([#8]C2([#6])[#6])[#6]3=O |r,c:15,TLB:5:3:45.44:35,34:35:2.3.48:45.44,37:36:1.2:8.5,9:8:1.2:48.36,THB:6:5:1.2:48.36,8:35:2.3.48:45.44,49:48:45.44:35,49:48:1.2:8.5,45:1:48.36:8.5|
[H][C@@]12[#6][C@@]3([H])[#6]=[#6]4-[#6](=O)-c5c(-[#8])c6-[#6]=[#6]C([#6])([#6])[#8]-c6c(-[#6]\[#6]=[#6](/[#6])-[#6])c5-[#8][C@@]14[C@]([#8]C2([#6])[#6])(\[#6]=[#6](\[#6])-[#6]-[#8])[#6]3=O |r,c:13,t:5,TLB:27:28:30.31:39.3.2,30:29:6.5:1.2,40:39:6.5:1.2,5:3:28:30.31,THB:31:1:6.5:29.39,7:6:29.39:1.2,40:39:28:30.31,34:29:6.5:1.2|
CCOS(=O)(=O)\C=C\c1ccc(OC2CCC(CC2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |(68.2,-19.45,;66.66,-19.54,;65.81,-18.26,;64.27,-18.35,;64.36,-19.88,;62.99,-19.19,;63.42,-17.07,;61.89,-17.17,;61.03,-15.89,;59.5,-15.98,;58.65,-14.7,;59.34,-13.32,;58.57,-11.98,;57.03,-11.98,;56.26,-13.31,;54.72,-13.31,;53.95,-11.98,;54.72,-10.65,;56.26,-10.65,;52.41,-11.98,;51.64,-10.65,;52.33,-9.27,;51.47,-7.99,;49.93,-8.09,;49.07,-6.82,;49.75,-5.43,;48.89,-4.15,;47.62,-5,;47.52,-3.47,;49.56,-2.77,;48.7,-1.5,;49.38,-.11,;49.26,-9.49,;50.12,-10.76,;60.87,-13.22,;61.72,-14.5,)|
CCOS(=O)(=O)\C=C\c1ccc(OCCCCOc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCOc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCOc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1
NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)Cc1ccc(cc1)C(F)(F)P(O)(O)=O |r|
COc1cc(\C=C2/SC(=S)N(C2=O)c2cccc(Cl)c2)cc(c1O)[N+]([O-])=O
[O-][V](=O)([O-])[O-]
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc4ccccc4c3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)(C)C)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)C)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(Br)cc3Cl)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(cc3)C(F)(F)F)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccccc3F)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(F)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(cc2)C(C)C)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(O)=O)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2cccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3cccc(c3)-c3ccccc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(CC)cc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3cccc(c3)C(F)(F)F)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(Oc3ccc(F)cc3)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)Nc2ccc(OC)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccc(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)c(c2)C(=O)OC)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCOc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1
[H][C@@]12CCC=C(COC(=O)c3ccc[nH]3)[C@]1(C)CC[C@H](C)[C@@]2(C)CC\C(C)=C\Cn1c[n+](C)c2ncnc(N)c12 |r,t:4|
[H][C@@]12CCC=C(COC(=O)c3cc(Br)c[nH]3)[C@]1(C)CC[C@H](C)[C@@]2(C)CC\C(C)=C\C[n+]1cn(C)c2ncnc(N)c12 |r,t:4|
[H][C@]12CC(C)(C)C(O1)=CC(=O)[C@@](C)(O)C2 |r,wU:11.12,1.0,t:8,(53.59,-27.29,;55.1,-27.6,;56.19,-28.69,;57.73,-28.68,;59.06,-29.45,;57.73,-30.22,;58.83,-27.6,;56.58,-27.19,;58.83,-26.05,;57.73,-24.97,;58.32,-23.54,;56.19,-24.97,;56.19,-23.43,;54.86,-24.2,;55.1,-26.05,)|
CC(C)[C@@H]1CC\C(COC(C)=O)=C\CCC(=C)[C@@H](O)[C@@H]1O |r,t:11|
[H][C@@]12CC(=O)[C@@](C)(C[C@@H]1O)C2(C)C |r,TLB:4:3:10:8.7,THB:9:8:10:3.2|
[H][C@]12C(=CC[C@]1(C)[C@@H](O)C[C@]1(C)[C@]2([H])CC[C@]2([H])[C@@]3(C)CC[C@H](OC(=O)CCCCCCCCCCCCCCC)C(C)(C)[C@]3([H])CC[C@@]12C)C(C)=C |r,c:2|
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc(\[#6]=[#6]\[#6](=O)-c2ccc3-[#8]C([#6])([#6])[#6]=[#6]-c3c2-[#8])ccc1-[#8] |c:20|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6@@H]-2-[#6]-[#8]-c3c(-[#6]-2)ccc2-[#8]C([#6])([#6])[#6]=[#6]-c32)c1-[#8] |r,c:25|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2ccc3-[#8]C([#6])([#6])[#6]=[#6]-c3c2-[#8]-1 |r,c:25|
[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])ccc2-[#6](=O)-[#6]-[#6@H](-[#8]-c12)-c1ccc2-[#8]C([#6])([#6])[#6]=[#6]-c2c1 |r,c:27|
CCCCCCCCCCCCCCCC(=O)C1=C(O)[C@@H](CO)OC1=O |r,c:17|
CC(C)(C=C)c1cc(O)c2oc3c(O)c4occc4cc3c(=O)c2c1O
Oc1ccc2oc3cccc(O)c3c(=O)c2c1
CC(C)(C=C)c1cc(O)c(O)c2c1oc1c(O)c3OC(C)(C)C=Cc3cc1c2=O |c:23|
CC(C)(C=C)c1cc(O)c(O)c2c1oc1c(O)cccc1c2=O
CC(C)(C=C)c1cc(O)c(O)c2c1oc1c(O)c3occc3cc1c2=O
Oc1cccc2c1oc1c(O)ccc(O)c1c2=O
Oc1ccc2oc3ccc(O)c(O)c3c(=O)c2c1
CC(C)(C=C)c1cc(O)c(O)c2c1oc1c(O)c(O)ccc1c2=O
CC(C)(C=C)c1cc(O)c2oc3c(O)c(O)ccc3c(=O)c2c1O
[#6]-[#8]-c1c(-[#8])cc2oc3cc4occc4c(-[#8])c3c(=O)c2c1-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6]
CC(C)(C=C)c1cc(O)c2oc3c(O)c4OC(C)(C)C=Cc4cc3c(=O)c2c1O |c:19|
CCCc1cc(O)cc(O)c1C(=O)Oc1cc(O)c(C(=O)Oc2cc(O)c(C(O)=O)c(CCC)c2)c(CCC)c1
CCCc1cc(O)cc(OC(=O)c2c(O)cc(O)cc2CCC)c1
CCCc1cc(O)cc(O)c1C(=O)Oc1cc(O)c(C(O)=O)c(CCC)c1
CCC\C=C\C=C\CCc1cc(O)cc(O)c1C(O)=O
CCCc1cc(OC)cc(OC)c1C(O)=O
CCCc1cc(O)cc(O)c1C(O)=O
CC1(C)\C(=C/C=C/C2=[N+](CCCCS(O)(=O)=O)c3ccc(cc3C2(C)C)[As]2SCCS2)N(CCCCS(O)(=O)=O)c2ccc(cc12)[As]1SCCS1 |c:7|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1c(O)c(O)cc2nc(C)oc12 |r|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@H](O)C[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:19|
[H][C@@]12CC(C)(C)C[C@H](OC(=O)C(\C)=C/C)[C@]1(CO)[C@H](OC(C)=O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:29|
[H][C@@]12[C@@H](CC[C@]1(C)CC[C@]1(C)C2CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(C)(C)O |r|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@H](O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:20|
[H][C@@]12CC(C)(C)CC[C@]1(CO)[C@H](O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:19|
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C |r,c:10|
CC1(C)CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:11|
[H][C@@]12CC[C@]3(C)[C@]([H])([C@H](O)C(=O)[C@]4(O)[C@]5([H])CC(C)(C)CC[C@]5(C)CC[C@@]34C)[C@@]1(C)CC[C@H](O)C2(C)C |r|
[H][C@@]12CC(C)(C)C[C@H](OC(=O)C(\C)=C/C)[C@]1(CO)[C@H](O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:26|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@H](O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:20|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(COC(=O)C(\C)=C/C)[C@H](O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:26|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@H](O)[C@H](OC(C)=O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:23|
[H][C@@]12CC(C)(C)C[C@H](OC(=O)C(\C)=C/C)[C@]1(CO)[C@H](O)[C@H](OC(C)=O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:29|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@H](OC(C)=O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:23|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@@H](C[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)OC(C)=O |r,t:18|
[H][C@@]12CC(C)(C)C[C@H](O)[C@]1(CO)[C@H](OC(C)=O)[C@H](O)[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CCC(=O)C(C)(C)[C@]3([H])CC[C@@]12C |r,t:23|
CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 |r|
Oc1ccc(cc1O)-c1nnc(SCC(=O)Oc2ccc(Oc3ccccc3)cc2)o1
CCOc1ccc(OC(=O)CSc2nnc(o2)-c2ccc(O)c(O)c2)cc1
Oc1ccc(cc1O)-c1nnc(SCC(=O)c2ccccc2)o1
Oc1ccc(cc1O)-c1nnc(SCc2ccccc2)o1
COCCc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
CCOc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
CCC(C)(C)c1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
CC(C)c1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
Oc1ccc(cc1O)-c1ncc(o1)-c1ccc(Oc2ccc(cc2)-c2ccccc2)cc1
CC(C)(C)c1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
COc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
Cc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2ccc(O)c(O)c2)cc1
Oc1ccc(cc1O)-c1ncc(o1)-c1ccc(Oc2ccccc2)cc1
COCCc1ccc(Oc2ccc(OC(=O)CSc3nnc(o3)-c3ccc(O)c(O)c3)cc2)cc1
CC(C)(C)c1ccc(Oc2ccc(OC(=O)CSc3nnc(o3)-c3ccc(O)c(O)c3)cc2)cc1
Oc1ccc(cc1O)-c1nnc(SCC(=O)Oc2ccc(Oc3ccc(OCc4ccccc4)cc3)cc2)o1
CCOc1ccc(Oc2ccc(OC(=O)CSc3nnc(o3)-c3ccc(O)c(O)c3)cc2)cc1
CC(C)c1ccc(Oc2ccc(OC(=O)CSc3nnc(o3)-c3ccc(O)c(O)c3)cc2)cc1
Cc1ccc(Oc2ccc(OC(=O)CSc3nnc(o3)-c3ccc(O)c(O)c3)cc2)cc1
Oc1ccc(cc1O)-c1nnc(SCC(=O)Oc2ccc(OCc3ccccc3)cc2)o1
Oc1ccc(cc1O)-c1nnc(SCC(=O)Oc2ccc(cc2)C(F)(F)F)o1
Oc1ccc(cc1O)-c1nnc(SCC(=O)Oc2ccc(Br)cc2)o1
COc1ccc(OC(=O)CSc2nnc(o2)-c2ccc(O)c(O)c2)cc1
Cc1ccc(OC(=O)CSc2nnc(o2)-c2ccc(O)c(O)c2)cc1
Oc1ccc(cc1O)-c1nnc(SCC(=O)Oc2ccccc2)o1
COC(=O)CSc1nnc(o1)-c1ccc(O)c(O)c1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OC)cc1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)OC
CCCOc1ccc(NC(=O)NCc2cc(OCC)c(NS(C)(=O)=O)cc2OCC)cc1C(=O)OC
CCCCOc1ccc(NC(=O)NCc2cc(OCC)c(NS(C)(=O)=O)cc2OCC)cc1C(=O)OC
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)NC
CCNC(=O)c1cc(NC(=O)NCc2cc(OCC)c(NS(C)(=O)=O)cc2OCC)ccc1OCC
CCCNC(=O)c1cc(NC(=O)NCc2cc(OCC)c(NS(C)(=O)=O)cc2OCC)ccc1OCC
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)Nc1ccc(C)cc1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)Nc1cccc(OC)c1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OCC)c(c1)C(=O)Nc1ccc(OC)c(OC)c1
CCCCCc1c(Oc2cc(OC)cc3c2C(=O)OC3(O)CCCC)c(O)cc(O)c1C(O)=O
CCCCCc1c(Oc2cc(OC)cc3c2C(=O)OC3(CCCC)OC)c(O)cc(O)c1C(O)=O
CC1=CCC(=C\C1=N\C(=O)C1=CC=C\C(C1)=N/C(=O)/N=C1/CC(=CC=C1)C(=O)\N=C1\CC(=CC=C1C)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O)C(=O)\N=C1/CC=C(c2cc(cc(c12)S(O)(=O)=O)S(O)(=O)=O)S(O)(=O)=O |c:4,13,24,26,34,36,45,72,t:1,11|
CCCCCc1cc(O)cc(O)c1Oc1cc(OC)cc2c1C(=O)OC2(O)CCCC
CCCCCc1c(Oc2cc(OC)cc3\C(OC(=O)c23)=C\CCC)c(O)cc(O)c1C(O)=O
CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(O)c1C(O)=O
Nc1cc2nsnc2cc1C#C
C(Nc1ccc2nsnc2c1)c1ccccc1
C(Nc1ccc2nsnc2c1)c1cccs1
Nc1cc2nsnc2cc1C#Cc1ccccc1
Nc1cc2nsnc2cc1C#CCCCCCl
C\C(CCC(O)C(C)=C)=C/COc1ccc2oc3cc(O)cc(O)c3c(=O)c2c1
[#6]-[#8]-c1c(-[#8])cc2oc3cc(-[#8])c(-[#6]-[#6]C([#6])([#6])[#8])c(-[#8])c3c(=O)c2c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2oc3ccc(-[#8])cc3c(=O)c2c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c(-[#6]-[#6](-[#8])-[#6](-[#6])=[#6])c(-[#8])c2c1oc1ccc(-[#8])cc1c2=O
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]C([#6])([#8])[#6]-1-[#6]-c2c(-[#8]-1)c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c1c2oc2ccc(-[#8])cc2c1=O
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](=[#6])-[#6](-[#8])-[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c1oc1ccc(-[#8])cc1c2=O
[#6]-[#8]-c1c(-[#8])cc2oc3cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c3c(=O)c2c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc2oc3cc(-[#8])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c3c(=O)c2c1-[#8]
COc1c(O)ccc2c1oc1c3c(OC(CO)C3(C)C)cc(O)c1c2=O
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1cc2oc3ccc(-[#8])cc3c(=O)c2c(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c1oc1ccc(-[#8])cc1c2=O
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#8]-c1ccc2oc3cc(-[#8])cc(-[#8])c3c(=O)c2c1
COc1cc(\C=C\C(=O)O[C@@H]2C[C@](O)(C[C@@H](O)[C@@H]2OC(=O)\C=C\c2ccc(O)c(OC)c2)C(O)=O)ccc1O |r|
O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1O)C(O)=O |r|
c1cc(c(cc1/C=C/C(=O)O[C@@H]2C[C@@](C[C@H]([C@H]2O)O)(C(=O)O)O)O)O
O[C@@H]1C[C@@](C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1O)(OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r|
O[C@@H]1C[C@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r|
COC(=O)[C@@]1(O)C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H](O)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r,wU:4.3,7.7,wD:21.22,23.26,(22.67,-40.58,;22.68,-42.11,;24.02,-42.88,;25.35,-42.1,;24.02,-44.42,;22.7,-45.2,;25.35,-43.64,;26.68,-44.42,;28.02,-43.65,;29.35,-44.43,;29.35,-45.97,;30.69,-43.66,;32.01,-44.44,;33.35,-43.67,;33.34,-42.14,;34.67,-41.37,;36.01,-42.14,;37.35,-41.38,;36.01,-43.68,;37.34,-44.46,;34.67,-44.45,;26.68,-45.96,;28.02,-46.73,;25.35,-46.72,;24.02,-45.96,;25.35,-48.26,;24.02,-49.03,;24.02,-50.57,;22.69,-48.26,;21.36,-49.03,;20.02,-48.26,;20.02,-46.71,;18.69,-45.95,;17.36,-46.72,;16.02,-45.95,;17.37,-48.26,;16.04,-49.04,;18.69,-49.03,)|
O[C@@H]1C[C@@](O)(C[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r|
O[C@@H]1C[C@@](O)(C[C@@H](O)[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O |r,wU:1.0,3.23,wD:6.6,8.9,3.3,(33.7,-33.22,;32.36,-32.45,;32.36,-30.91,;31.02,-30.13,;30.04,-28.95,;29.69,-30.91,;29.69,-32.45,;28.36,-33.22,;31.02,-33.22,;31.02,-34.76,;31.88,-35.26,;31.87,-36.8,;33.22,-34.51,;34.55,-35.29,;35.89,-34.53,;35.91,-32.99,;37.24,-32.23,;38.57,-33.01,;39.91,-32.25,;38.55,-34.55,;39.88,-35.33,;37.22,-35.31,;32.02,-28.95,;31.49,-27.51,;33.54,-29.23,)|
O[C@H]1[C@@H](C[C@@](O)(C[C@H]1OC(=O)\C=C\c1ccc(O)c(O)c1)C(O)=O)OC(=O)\C=C\c1ccc(O)c(O)c1 |r,wU:2.25,4.22,wD:1.0,7.8,4.4,(-1.06,-23.53,;-1.06,-21.99,;.29,-21.22,;.29,-19.66,;-1.06,-18.89,;.22,-18.03,;-2.39,-19.66,;-2.39,-21.22,;-3.73,-21.99,;-3.73,-23.53,;-2.39,-24.3,;-5.06,-24.3,;-5.06,-25.84,;-6.39,-26.61,;-7.73,-25.84,;-9.06,-26.61,;-9.06,-28.15,;-10.39,-28.92,;-7.72,-28.92,;-7.71,-30.46,;-6.39,-28.15,;-1.91,-17.6,;-.95,-16.4,;-3.45,-17.53,;1.62,-21.99,;1.61,-23.53,;.28,-24.3,;2.95,-24.3,;2.94,-25.84,;4.27,-26.62,;4.26,-28.16,;5.59,-28.93,;6.93,-28.16,;8.26,-28.93,;6.93,-26.61,;8.26,-25.84,;5.6,-25.85,)|
COC(=O)[C@]1(O)C[C@@H](O)[C@@H](OC(=O)\C=C\c2ccc(O)c(O)c2)[C@@H](C1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r|
[H][C@@]12CC[C@]3(C)Oc4cc(O)cc(C)c4[C@@]([H])([C@]13[H])C2(C)C |r|
[H][C@]12[C@H]3O[C@]33C(C)=CC(=O)C=C3O[C@@]1(C)CC[C@@H]2C(C)(C)O |r,c:7,11|
[H][C@]12[C@@H](O)[C@](C)(CC[C@H]1C(C)=C)Oc1cc(O)cc(C)c21 |r,THB:3:2:20.13.12:6.7.8|
[H][C@@]12[C@H](O)[C@@](C)(CC[C@@H]1C(C)=C)Oc1cc(O)cc(C)c21 |r,THB:3:2:20.13.12:6.7.8|
[H][C@]12Cc3c(C)cc(O)cc3O[C@@]1(C)CC[C@H]2C(C)=C |r|
[H][C@@]12OC(C)(C)[C@]3([H])CC[C@@](C)(Oc4cc(O)cc(C)c4O1)[C@@]23[H] |r|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#6])cc1-[#8]
OC(=O)c1noc(c1-c1cccc(c1)-c1ccc(O)c(Cl)c1)-c1ccccc1
OC(=O)c1noc(c1-c1cccc(c1)-c1cccc(O)c1)-c1ccccc1
OC(=O)c1noc(c1-c1cccc(c1)-c1ccc(O)cc1)-c1ccccc1
OC(=O)c1noc(c1-c1cccc(c1)-c1cc(Cl)cc(Cl)c1)-c1ccccc1
Cc1cc(cc(C)c1O)-c1cccc(c1)-c1c(noc1-c1ccccc1)C(O)=O
OC(=O)c1noc(c1-c1cccc(c1)-c1ccc(O)c(F)c1)-c1ccccc1
OC(=O)c1noc(c1-c1ccccc1)-c1ccccc1
OC(=O)c1noc(c1-c1cccc(c1)-c1cc(Cl)c(O)c(c1)[N+]([O-])=O)-c1ccccc1
OC(=O)c1noc(c1-c1cccc(c1)-c1cc(Cl)c(O)c(Cl)c1)-c1ccccc1
COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O
[H][C@@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@@]1([H])[C@H](OC(=O)c1cc(O)c(O)c(O)c1)[C@@H](O)[C@H](Oc1cc(O)c(C(=O)CCc3ccccc3)c(O)c1)O2 |r|
[H][C@@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@@]1([H])[C@H](OC(=O)c1cc(O)c(O)c(O)c1)[C@@H](O)[C@H](Oc1cc(O)cc(O)c1C(=O)CCc1ccc(O)c(O)c1)O2 |r|
[H][C@@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@@]1([H])[C@H](O)[C@@H](O)[C@H](Oc1cc(O)c(C(=O)CCc3ccccc3)c(O)c1)O2 |r|
[H][C@@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@@]1([H])[C@H](OC(=O)c1cc(O)c(O)c(O)c1)[C@@H](O)[C@H](Oc1cc(O)cc(O)c1C(=O)CCc1ccc(O)cc1)O2 |r|
[H][C@@]12COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@@]1([H])[C@H](O)[C@@H](O)[C@H](Oc1cc(O)c(C(=O)CCc3ccc(O)cc3)c(O)c1)O2 |r|
CC(=O)CC[C@@H]1C[C@@]2(OC1(C)C)C(=O)CC[C@@]2(C)O |r|
c1cc(c(cc1O)O)/C=C/c2cc(cc(c2)O)O
Oc1ccc(c(O)c1)-c1cc(=O)c2c(O)cc(O)cc2o1
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(oc2c3-[#6]=[#6]C([#6])([#6])[#8]-c3cc(-[#8])c2c1=O)-c1ccc(-[#8])cc1-[#8] |c:10|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc2-[#8]-[#6@@H](-[#6]-[#6](=O)-c2c1-[#8])-c1cc2-[#6]=[#6]C([#6])([#6])[#8]-c2cc1-[#8] |c:23|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(oc2c(-[#6@@H]-3-[#6]=[#6](-[#6])-[#6]-[#6@@H](-[#6@H]-3-[#6](=O)-c3ccc(-[#8])cc3-[#8])-c3ccc(-[#8])cc3-[#8])c(-[#8])cc(-[#8])c2c1=O)-c1ccc(-[#8])cc1-[#8] |r,t:11|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)-[#6@@H]-2-[#6@H](-[#6]-[#6](-[#6])=[#6]-[#6@@H]-2-c2c(-[#8])cc(cc2-[#8])-c2cc3ccc(-[#8])cc3o2)-c2ccc(-[#8])cc2-[#8])c1-[#8] |r,c:17|
CC1=C[C@H]([C@@H]([C@H](C1)c1ccc(O)cc1O)C(=O)c1ccc(O)cc1O)c1c(O)ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)c1O |r,t:1|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)-[#6@@H]-2-[#6@H](-[#6]-[#6](-[#6])=[#6]-[#6@H]-2-c2c(-[#8])cc(-[#8])c3c2oc(c(-[#6]\[#6]=[#6](\[#6])-[#6])c3=O)-c2ccc(-[#8])cc2-[#8])-c2ccc(-[#8])cc2-[#8])c1-[#8] |r,c:17|
FC(F)(F)Sc1ccc(CNCc2ccc(SC(F)(F)F)cc2)cc1
FC(F)(F)Sc1ccc(NCc2ccccc2)cc1
[O-][N+](=O)c1ccc(\C=N\NC(=S)Nc2cccc3ccccc23)cc1
FC(F)(F)c1ccc(Cl)c(c1)-c1ccc(\C=N\NC(=S)Nc2cccc3ccccc23)o1
Cc1ccc(NC(=S)N\N=C\c2ccc(o2)-c2cc(ccc2Cl)C(F)(F)F)cc1
S=C(N\N=C\c1ccc(cc1)-c1ccccc1)Nc1cccc2ccccc12
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccsc1
c1ccc(c(c1)C(=O)O)NC(=O)C(=O)O
OC1CCc2c(C1)sc(NC(=O)C(O)=O)c2C(O)=O
CC(C)Cc1ccc(cc1)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
C1CSCc2c1c(c(s2)NC(=O)C(=O)O)C(=O)O
Cc1cccc(C(O)=O)c1NC(=O)C(O)=O
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1cccc(c1)[N+]([O-])=O
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccccc1
OC(=O)C(=O)Nc1sc2CCCc2c1C(O)=O
OC(=O)C(=O)Nc1cc2[nH]ccc2cc1C(O)=O
OC(=O)C(=O)Nc1ccc2cc[nH]c2c1C(O)=O
c1cc(c(cc1I)C(=O)O)NC(=O)C(=O)O
Cc1csc(C(O)=O)c1NC(=O)C(O)=O
COc1cccc(c1)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
OC(=O)COc1ccc(cc1)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
OC(=O)C(=O)Nc1sccc1C(O)=O
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccc(Cl)cc1
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccc(F)cc1
OC(=O)C(=O)Nc1ccc(cc1C(O)=O)-c1ccccc1
COc1ccc(cc1OC)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccc(OCc2ccccc2)cc1
C1COCc2c1c(c(s2)NC(=O)C(=O)O)C(=O)O
COc1cc(OC)cc(c1)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
OC(=O)C(=O)Nc1cnccc1C(O)=O
OC(=O)C(=O)Nc1sc2CC(=O)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CS(=O)CCc2c1C(O)=O
OC(=O)C(=O)Nc1cscc1C(O)=O
COc1ccc(cc1)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
c1ccc2cc(c(cc2c1)C(=O)O)NC(=O)C(=O)O
OC(=O)C(=O)Nc1sc2CCCCc2c1C(O)=O
Nc1cccc(c1)-c1cc(NC(=O)C(O)=O)c(s1)C(O)=O
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccc(Oc2ccccc2)cc1
CN(C(=O)C(O)=O)c1ccccc1C(O)=O
OC(=O)C(=O)Nc1cc(sc1C(O)=O)-c1ccc(O)cc1
OC(=O)C(=O)Nc1sc2CCCCCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CC3(CCc2c1C(O)=O)OCCO3
OC(=O)C(=O)Nc1ccsc1C(O)=O
Cc1cccc(NC(=O)C(O)=O)c1C(O)=O
OC(=O)C(=O)Nc1sc2CS(=O)(=O)CCc2c1C(O)=O
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C(=O)[C@@](O)(C[C@]4(C)[C@@]3([H])CC[C@]12C)C(=O)OCC)[C@H](C)CCC(=C)C(C)C |r,t:9|
[H][C@]12OO[C@](C)(C=C1)[C@@](C)(CCC1=CC(O)OC1=O)[C@@H]2C |r,c:6,t:13|
[H][C@@]12C[C@H](C)[C@](C)(CCc3ccoc13)C(C)=C2 |r,c:17,TLB:10:9:2.3:14.16,12:13:2.3:14.16,THB:4:3:7.8.13.9:14.16,15:14:7.8.13.9:2.3|
C[C@@H]1CC=CC(=C)[C@]1(C)CCC1=CC(O)OC1=O |r,c:3,t:12|
C[C@@H]1CCCC(=C)[C@]1(C)CCc1ccoc1 |r|
[H][C@@]12OC(=O)C(=C1)[C@@H](OC(=O)CCCCCCCCCCCCCCC)[C@H](O)[C@H](Cc1oc(cc1C(=O)OC)[C@@H]2C(C)=C)C(C)=C |r,c:5|
Cc1cc(C)c(Oc2cc(Br)cc(Br)c2Br)c(Br)c1
COc1cc(C(=O)c2c(Br)c(Br)c(OC)c(OC)c2Br)c(Br)c(Br)c1OC
BrCc1cc(Br)c2cc(NBr)c(Br)c(Br)c2c1
BrCc1cc2cc(Br)c(NBr)cc2c(Br)c1Br
BrCc1cc(Br)c2cc(NBr)c(Br)cc2c1Br
CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(Cc1ccc(NS(O)(=O)=O)cc1)c1ccccc1
OS(=O)(=O)Nc1ccc(CN(C(=O)c2cccnc2Cl)c2nc(cs2)-c2ccccc2)cc1
COc1cccc(c1)S(=O)(=O)N(Cc1ccc(NS(O)(=O)=O)cc1)c1nc(cs1)-c1ccccc1
OS(=O)(=O)Nc1ccc(CNc2nc(cs2)-c2cccs2)cc1
[O-][N+](=O)c1ccc(CNc2ccccc2)cc1
CC(=O)C(=O)N(c1ccccc1CCO)c1ccccc1C(O)=O
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)OC(C)(C)C |r|
CCCCCNC(=O)[C@H](Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(\C=C\C(N)=O)c1)NS(C)(=O)=O |r|
CC(=O)C(=O)N(c1cccc2CCCCc12)c1ccccc1C(O)=O
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OC(C(N)=O)C(O)=O)cc1)NC(=O)OC(C)(C)C |r|
CCc1cc(C[C@H](NC(C)=O)C(=O)NCCCCC(=O)NCCc2ccccc2)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CC(=O)C(=O)N(c1ccccc1Cc1ccccc1)c1ccccc1C(O)=O
CC(=O)C(=O)N(c1cccc(C)c1C)c1ccccc1C(O)=O
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(cc1)N(CC(C)C(O)=O)C(=O)C(O)=O)NC(=O)OC(C)(C)C
CC(=O)C(=O)N(c1ccccc1N1CCCCC1)c1ccccc1C(O)=O
CCCCCNC(=O)[C@H](Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NS(C)(=O)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(C)=O |r|
CCc1ccccc1N(C(=O)C(C)=O)c1ccccc1C(O)=O
CC(=O)C(=O)N(c1ccc2ccccc2c1)c1ccccc1C(O)=O
CC(=O)C(=O)N(c1ccccc1C(O)=O)c1cccc2ccccc12
CC(=O)N[C@@H](Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)C(=O)NCCCCCOc1cc2ccccc2cc1C(O)=O |r|
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)OC(C)(C)C |r|
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OC(C)C(O)=O)c(c1)C(O)=O)NC(=O)OC(C)(C)C
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)OC(C)(C)C
COC(=O)c1c(O)cccc1OCCCCNC(=O)C(Cc1ccc(cc1)N(CC(C(O)=O)c1ccccc1)C(=O)C(O)=O)NC(=O)OC(C)(C)C
CCc1cc(C[C@H](NC(C)=O)C(=O)NCc2ccc(OC)cc2)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CCc1cc(C[C@H](NC(C)=O)C(=O)NCc2ccc(Cl)cc2)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CCc1cc(C[C@H](NC(C)=O)C(=O)NCCCCC(=O)NC(Cc2ccccc2)C(N)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
COC(=O)c1c(O)cccc1OC\C=C\c1ccc(F)c(c1)-c1cc(no1)C(O)=O
CC(C)c1ccccc1N(C(=O)C(C)=O)c1ccccc1C(O)=O
CC(=O)C(=O)N(c1ccccc1C(O)=O)c1cccc2ccc(O)cc12
CCCCCNC(=O)[C@H](Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)NC(C)=O |r|
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(=O)NC2CC2)cc1)NC(=O)OC(C)(C)C |r|
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OC(C)C(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(C)=O
CC(=O)C(=O)N(c1ccccc1\C=C\C(N)=O)c1ccccc1C(O)=O
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(NC(=O)C(O)=O)cc1)NC(=O)OC(C)(C)C |r|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(=O)OC(C)(C)C |r|
CCC(CN(C(=O)C(O)=O)c1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)cc1)C(O)=O
CCc1cc(C[C@H](NC(C)=O)C(=O)N[C@H](CCSC)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CCC(CC(O)=O)N(C(=O)C(O)=O)c1ccc(CC(NC(=O)OC(C)(C)C)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)cc1
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(=O)OCC=C
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCc1ccccc1 |r,c:10|
COC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 |r,t:13|
CC1(C)CC[C@]2(CC(=O)NC(Cc3ccc(Cl)cc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:27|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCCCC(O)=O |r,c:10|
CC1(C)CC[C@]2(CC(=O)NC(Cc3ccc4OCOc4c3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCC(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCCCCCC(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)CCC(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CSCCC(NC(=O)C[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:18|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5[C@H](O)C[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
COc1cc(CC(NC(=O)C[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc(OC)c1 |r,t:20|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCCCCCCCCCC(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=C)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccccc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6ccc(cc6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:29|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](Cc6ccccc6C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](Cc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6ccccc6C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CCOC(=O)C(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C |r,t:21|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
COc1ccc(CC(NC(=O)C[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc1OC |r,t:21|
COc1cccc(CC(NC(=O)C[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)c1OC |r,t:22|
Cc1ccc(CC(NC(=O)C[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc1 |r,t:20|
Cc1ccccc1CC(NC(=O)C[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:23|
CC1(C)CC[C@]2(CC(=O)NC(Cc3ccc(cc3)[N+]([O-])=O)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:29|
CC1(C)CC[C@]2(CC(=O)NC(Cc3cccc(Cl)c3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:27|
CC1(C)CC[C@]2(CC(=O)NC(Cc3ccccc3Cl)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:27|
CC1(C)CC[C@]2(CC(=O)NC(Cc3cnc[nH]3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:25|
CC1(C)CC[C@]2(CC(=O)NC(Cc3ccccc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:26|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCC(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCc1ccccc1 |r,c:10|
CNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 |r,t:13|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(N)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)Nc1ccc(cc1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NC(Cc1ccccc1)C(O)=O |r,c:10|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NC(CCC(O)=O)C(O)=O |r,c:10|
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC(=O)[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6ccc(cc6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6cccc(c6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC(C)(CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@@]4(CC[C@@]32C)C(O)=O)C1(C)C)C(O)=O |r,t:20|
COc1ccc(CC(NC(=O)C[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc1 |r,t:21|
COc1ccccc1CC(NC(=O)C[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:24|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCCCCCCCC(O)=O |r,c:10|
OC(=O)C(=O)c1ccc(OCc2ccc(COc3ccc(cc3)C(=O)C(O)=O)cc2)cc1
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@]2(CC(=O)NC(Cc3ccc(F)cc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:27|
COc1cccc(CC(NC(=O)C[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)c1 |r,t:22|
CC1(C)CC[C@]2(CC(=O)NC(CC3=CCc4ccccc34)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30,t:12|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)OCCCCC(O)=O |r,c:10|
NC(=O)[C@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccccc1 |r|
NC(=O)[C@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1ccccc1 |r,t:12|
COc1ccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccc(cc2)C2CC(=O)NS2(=O)=O)C(N)=O)cc1 |r|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)N1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r|
N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)C(N)=O |r,t:22|
N[C@@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C(N)=O |r|
NC(=O)[C@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 |r|
NC(=O)[C@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)cc1 |r,t:12|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)C(N)=O |r,t:25|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)C(N)=O |r|
N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C(N)=O |r|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)C1=CS(=O)(=O)NC1=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r,t:17|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r,t:17|
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C(N)=O |r|
NC(=O)[C@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1ccccc1 |r|
NC(=O)[C@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(cc1)C(F)(F)F |r|
NC(=O)[C@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)cc1 |r|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C(N)=O |r|
COc1ccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccc(cc2)C2=CC(=O)NS2(=O)=O)C(N)=O)cc1 |r,t:31|
NC(=O)[C@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccccc1 |r,t:12|
NC(=O)[C@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1 |r,t:12|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)[C@H]1CC(=O)NS1(=O)=O)C(N)=O |r|
CC(=O)N[C@@H](Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C(N)=O |r|
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(N)=O |r|
NC(=O)[C@H](Cc1ccc(cc1)C1=CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(cc1)C(F)(F)F |r,t:12|
CCCCCNC(=O)[C@H](Cc1ccc(cc1)[C@H]1CC(=O)NS1(=O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c2-[#8]\[#6](=[#6]/c3ccc(-[#8])cc3)-[#6](=O)-c2ccc1-[#8]
OC(=O)c1cc2sc(Nc3cccc(Br)c3)nc2cc1O
NC(=O)[C@@H](CS)NC(=O)CCCCCNC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@@H](CC(O)=O)NC(=O)Cc1ccc(cc1)C(F)(F)P(O)(O)=O |r|
COC(CC(C)C)c1ccc2cc(cc(c2n1)P(O)(O)=O)-c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1
Fc1cccc(c1)S(=O)(=O)N[C@@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)c1nc(Cc2ccccc2F)c[nH]1 |r|
CO[C@@H](CC(C)C)c1ccc2cc(cc(c2n1)P(O)(O)=O)-c1ccc(C[C@](Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1 |r|
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OC(F)(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
[H][C@]12CC[C@]3([H])[C@@](C[C@@]1(C)O)(C[C@@]1([H])O[C@]4([H])O[C@@H](OC)C(C)(C)C[C@]4([H])[C@]3(C)O1)[C@@H]2O |r,THB:10:8:30:2.3.4|
[H][C@@]12[C@@H](O)[C@H](O)C(C)(C)[C@]11O[C@@](C)(O[C@@H]1Cc1cccc(C)c1)[C@@H]2C |r|
[H][C@]12CC[C@]3([H])[C@@](C[C@@]1(C)O)(C[C@H](OC)O[C@@]3(C)C1=CO[C@H](OC)C(C)(C)C1=O)[C@@H]2O |r,t:20,THB:9:8:29:2.3.4,10:8:29:2.3.4|
[H][C@]12CC[C@]3([H])[C@@](C[C@@]1(C)O)(C[C@@H](OC)O[C@@]3(C)C1=CO[C@H](OC)C(C)(C)C1=O)[C@@H]2O |r,t:20,THB:9:8:29:2.3.4,10:8:29:2.3.4|
[H][C@]12CC[C@@]3([H])C(=C)[C@@]4([H])C[C@H](O)C(C)(C)[C@@]4(O)[C@H](O)C[C@@]3(C=C1C)[C@@H]2O |r,c:24,THB:24:23:25:4.2.3|
[H][C@@]12[C@@H](O)[C@H](O)C(C)(C)[C@]11O[C@@](C)(O[C@@H]1Cc1cccc(C)c1)[C@H]2C |r|
[H][C@]12CC[C@@]3([H])C(=C)[C@@]4([H])C[C@H](O)C(C)(C)[C@@]4(O)[C@H](O)C[C@@]3(C[C@@]1(C)O)[C@@H]2O |r,THB:24:23:26:4.2.3,25:23:26:4.2.3|
[H][C@@]12O[C@]1([H])C(C)(C)[C@@]1(O)[C@H](O)C[C@@]34[C@@]5([H])O[C@@](C)([C@]3([H])C[C@H](O)[C@]4([H])C(C)=C5)[C@]21[H] |r,c:30,TLB:5:8:19:14.16,1:29:19:14.16,11:10:19:14.16,9:8:19:14.16|
OC(=O)CN1C(=S)S\C(=C/c2cn(nc2-c2cccc(Br)c2)-c2ccccc2)C1=O
OC(=O)CCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2Cl)-c2ccccc2)C1=O
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccc3ccccc3c2)-c2ccccc2)C1=O |r|
OC(=O)CN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Br)cc2)-c2ccccc2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2cn(nc2-c2ccc(cc2)[N+]([O-])=O)-c2ccccc2)C1=O
OC(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2)-c2ccccc2)C1=O
OC(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2Cl)-c2ccccc2)C1=O
OC(=O)CCCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2)-c2ccccc2)C1=O
OC(=O)CCCCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2)-c2ccccc2)C1=O
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccccc2Cl)-c2ccccc2)C1=O |r|
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2)-c2ccccc2)C1=O |r|
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2Cl)-c2ccccc2)C1=O |r|
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccccc2)-c2ccccc2)C1=O |r|
Cc1ccc(cc1)-c1nn(cc1\C=C1/SC(=S)N([C@H](Cc2ccccc2)C(O)=O)C1=O)-c1ccccc1 |r|
COc1ccccc1-c1nn(cc1\C=C1/SC(=S)N([C@H](Cc2ccccc2)C(O)=O)C1=O)-c1ccccc1 |r|
COc1ccc(cc1)-c1nn(cc1\C=C1/SC(=S)N([C@H](Cc2ccccc2)C(O)=O)C1=O)-c1ccccc1 |r|
OC(=O)CCCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2Cl)-c2ccccc2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2cn(nc2-c2ccc3ccccc3c2)-c2ccccc2)C1=O
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccc(cc2)[N+]([O-])=O)-c2ccccc2)C1=O |r|
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2cccc(Br)c2)-c2ccccc2)C1=O |r|
OC(=O)CN1C(=S)S\C(=C/c2cn(nc2-c2cccc(Cl)c2)-c2ccccc2)C1=O
Cc1ccc(cc1)-c1nn(cc1\C=C1/SC(=S)N(CC(O)=O)C1=O)-c1ccccc1
OC(=O)CCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2)-c2ccccc2)C1=O
OC(=O)CCCCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2Cl)-c2ccccc2)C1=O
OC(=O)[C@@H](Cc1ccccc1)N1C(=S)S\C(=C/c2cn(nc2-c2ccc(Br)cc2)-c2ccccc2)C1=O |r|
COc1cccc(c1)-c1nn(cc1\C=C1/SC(=S)N([C@H](Cc2ccccc2)C(O)=O)C1=O)-c1ccccc1 |r|
COc1ccccc1-c1nn(cc1\C=C1/SC(=S)N(CC(O)=O)C1=O)-c1ccccc1
COc1ccc(\C=C2/SC(=S)N(CC(O)=O)C2=O)cc1OCC(N)=O
COc1cc(\C=C2/S\C(=N/c3ccccc3)N(CC(O)=O)C2=O)ccc1OCc1ccccc1
OC(=O)CN1C(=S)S\C(=C/c2ccc(Oc3ccccc3)cc2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2ccc(OCc3ccccc3)cc2)C1=O
NC(=O)COc1cccc(\C=C2/SC(=S)N(CC(O)=O)C2=O)c1
COc1cc(\C=C2/SC(=S)N(CC(O)=O)C2=O)ccc1OCC(N)=O
OC(=O)CN1C(=S)S\C(=C/c2ccc(OCCc3ccccc3)cc2)C1=O
COc1cc(\C=C2/SC(=S)N(CC(O)=O)C2=O)ccc1OCc1ccccc1
COc1cc(\C=C2/SC(=O)N(CC(O)=O)C2=O)ccc1OCc1ccccc1
OC(=O)CN1C(=O)S\C(=C/c2cccc(OCCc3ccccc3)c2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2cccc(OCCc3ccccc3)c2)C1=O
OC(=O)CN1C(=S)S\C(=C/C=C/c2ccccc2)C1=O
OC(=O)CN1C(=O)S\C(=C/c2ccc(OCCc3ccccc3)cc2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2cccc(OCc3ccccc3)c2)C1=O
O[V](O)(O)=O
OC(=O)CN1C(=S)S\C(=C/c2cccc(Oc3ccccc3)c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4ccccc4)ccc3c2)C1=O
Cc1ccc(COc2ccc3cc(\C=C4/SC(=S)N(C(Cc5c[nH]c6ccccc56)C(O)=O)C4=O)ccc3c2)cc1
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc(OCc3ccc(Cl)cc3Cl)cc2)C1=O
COc1ccc(COc2ccc3cc(\C=C4/SC(=S)N(C(Cc5c[nH]c6ccccc56)C(O)=O)C4=O)ccc3c2)cc1
COc1ccccc1COc1ccc2cc(\C=C3/SC(=S)N(C(Cc4c[nH]c5ccccc45)C(O)=O)C3=O)ccc2c1
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4ccc(Cl)cc4)ccc3c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4cccc(Cl)c4)ccc3c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4ccc(F)cc4)ccc3c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4ccc(Br)cc4)ccc3c2)C1=O
COc1cc(\C=C2/SC(=S)N(C(Cc3c[nH]c4ccccc34)C(O)=O)C2=O)ccc1OCc1ccc(Cl)cc1
COc1cc(\C=C2/SC(=S)N(C(Cc3c[nH]c4ccccc34)C(O)=O)C2=O)ccc1OCc1ccc(C)cc1
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2cccc(OCc3ccc(Cl)cc3Cl)c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2cccc(OCc3ccc(Br)cc3)c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2cccc(OCc3ccccc3)c2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc(OCc3ccc(Br)cc3)cc2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc(OCc3ccccc3)cc2)C1=O
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4ccccc4Cl)ccc3c2)C1=O
COc1cc(\C=C2/SC(=S)N(C(Cc3c[nH]c4ccccc34)C(O)=O)C2=O)ccc1OCc1ccc(Br)cc1
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc(OCc3ccc(Cl)cc3)cc2)C1=O
COc1cc(\C=C2/SC(=S)N(C(Cc3c[nH]c4ccccc34)C(O)=O)C2=O)ccc1OCc1ccccc1
COc1cccc(COc2ccc3cc(\C=C4/SC(=S)N(C(Cc5c[nH]c6ccccc56)C(O)=O)C4=O)ccc3c2)c1
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2ccc3cc(OCc4ccc(Cl)cc4Cl)ccc3c2)C1=O
COc1cc(\C=C2/SC(=S)N(C(Cc3c[nH]c4ccccc34)C(O)=O)C2=O)ccc1OCc1ccc(Cl)cc1Cl
OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=S)S\C(=C/c2cccc(OCc3ccc(Cl)cc3)c2)C1=O
Cc1ccc(COc2ccc(\C=C3/SC(=S)N(C(Cc4c[nH]c5ccccc45)C(O)=O)C3=O)cc2)cc1
[#6]\[#6](-[#6])=[#6]\[#6][C@]12[#8]C([#6])([#6])[#6@H]3-[#6]-[#6@H](-[#6]=[#6]4-[#6](=O)-c5c(-[#8])cc(-[#8])cc5-[#8][C@]134)-[#6]2=O |r,t:13,TLB:28:27:26:6.7,28:27:13.14:11.10,4:5:13.14:11.10,6:5:13.14:11.10,THB:13:12:26:6.7|
N[C@@H](Cc1ccc(OC(F)(C(O)=O)C(O)=O)cc1)C(O)=O
CC(C)C[C@@H]1NC(=O)[C@H](Cc2ccc(OC(F)(C(O)=O)C(O)=O)cc2)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)CSCC(NC1=O)C(N)=O
N[C@@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)C(O)=O
OP(O)(=O)C(F)(F)c1ccc2ccccc2c1
OP(O)(=O)C(F)(F)c1cccc(c1)-c1ccccc1
OS(=O)(=O)C(F)(F)c1ccc2ccccc2c1
OS(=O)(=O)C(F)(F)c1cccc(c1)-c1ccccc1
CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(N)=O |r|
CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
CCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
FC(F)(c1nn[n-]n1)c1cccc(c1)-c1ccccc1
[O-]C(=O)C(F)(F)c1ccc2ccccc2c1
[O-]C(=O)C(F)(Oc1cccc(c1)-c1ccccc1)C([O-])=O
FC(F)(c1nn[n-]n1)c1ccc2ccccc2c1
[O-]C(=O)C(F)(F)c1cccc(c1)-c1ccccc1
[O-]S(=O)(=O)C(F)(F)c1cccc(c1)-c1ccccc1
[O-]P([O-])(=O)OC(F)(F)c1cccc(c1)-c1ccccc1
[O-]S(=O)(=O)C(F)(F)c1ccc2ccccc2c1
[O-]P([O-])(=O)OC(F)(F)c1ccc2ccccc2c1
[O-]C(=O)C(F)(Oc1ccc2ccccc2c1)C([O-])=O
Nc1ccc(NC(=O)C(O)=O)cc1
C[C@]12CC[C@](C)(C[C@H]1[C@]1(C)CC[C@]3(C)C(=CC=c4c3cc(O)c(O)c4=C)[C@@]1(C)CC2)C(O)=O |r,c:15,17|
O=[I](=O)c1cnc[nH]1
O=[I](=O)c1ccc(cc1)[I](=O)=O
O=[I](=O)c1ccccc1
[O-][N+](=O)c1ccc(cc1)[I](=O)=O
[O-][N+](=O)c1cccc(c1)[I](=O)=O
OC(=O)c1ccc(cc1)[I](=O)=O
Cc1ccc(cc1)[I](=O)=O
O[I]1(=O)OC(=O)c2ccccc12
CC(=O)O[I]1(OC(C)=O)(OC(C)=O)OC(=O)c2ccccc12
CC(C)(C)OO[I]1OC(=O)c2ccccc12
OC(=O)c1cccc(c1)[I](=O)=O
OP1(=O)Oc2ccccc2[I](O)(=O)O1
OP(O)(=O)C(F)(F)c1cccc(c1)C#C
CS(=O)(=O)Nc1cc(ccc1C#Cc1ccccc1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1ccc(\C=C\c2ccccc2)cc1
OP(O)(=O)C(F)(F)c1ccc(cc1)C#Cc1ccccc1
CS(=O)(=O)N(c1cc(ccc1\C=C\c1ccccc1)C(F)(F)P(O)(O)=O)S(C)(=O)=O
COc1ccc(cc1)-c1ccc(cc1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1ccc(cc1)-c1ccccc1
OP(O)(=O)C(F)(F)c1cccc(c1)C#Cc1ccccc1
CS(=O)(=O)Nc1cc(ccc1\C=C\c1ccccc1)C(F)(F)P(O)(O)=O
CS(=O)(=O)N(c1cc(ccc1C#Cc1ccccc1)C(F)(F)P(O)(O)=O)S(C)(=O)=O
OP(O)(=O)C(F)(F)c1ccc(cc1)C#C
OP(O)(=O)C(F)(F)c1cccc(\C=C\c2ccccc2)c1
OC(=O)c1cc2c(-c3cn(CC(=O)Nc4ccc(cc4)N4CCOCC4)nn3)c(oc2cc1O)-c1ccccc1
Fc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(F)cc3)ccc2o1
Cc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(C)c3)ccc2o1
CCCS(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)CCC)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
Fc1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
CCc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Fc1ccccc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Oc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(O)c3)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C#N)ccc2o1)c1ccc(cc1)C#N
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccs3)ccc2o1
Fc1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
O=S(=O)(Nc1ccc(cc1)-c1nc2ccccc2o1)c1ccccc1
COc1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Clc1ccc(cc1Cl)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3)ccc2o1)c1ccccc1
Fc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3F)ccc2o1
Fc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(F)c3)ccc2o1
Clc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3Cl)ccc2o1
Brc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3Br)ccc2o1
Brc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(Br)c3)ccc2o1
Cc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3C)ccc2o1
Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2o1
FC(F)(F)c1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3C(F)(F)F)ccc2o1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)ccc2o1
COc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3OC)ccc2o1
COc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(OC)cc3)ccc2o1
Oc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(O)cc3)ccc2o1
[O-][N+](=O)c1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3[N+]([O-])=O)ccc2o1
[O-][N+](=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)[N+]([O-])=O)ccc2o1
Nc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3N)ccc2o1
Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(N)cc3)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(c3)C#N)ccc2o1)c1cccc(c1)C#N
COC(=O)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(c3)C(=O)OC)ccc2o1
OC(=O)c1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3C(O)=O)ccc2o1
OC(=O)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(c3)C(O)=O)ccc2o1
OC(=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(O)=O)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccs3)ccc2o1)c1cccs1
O=S(=O)(Cc1ccccc1)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)Cc3ccccc3)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc4nonc34)ccc2o1)c1cccc2nonc12
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4ncsc4c3)ccc2o1)c1ccc2ncsc2c1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4ccccc4c3)ccc2o1)c1ccc2ccccc2c1
CS(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2cccs2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(C=C)cc2)cc1
CCc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc3ccccc3c2)cc1
CS(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Br)cc3)ccc2o1
NCc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
COc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)ccc2o1
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4ncsc4c3)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc4nonc34)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc4ccccc34)ccc2o1
CS(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Fc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Fc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Clc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Fc1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Cc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
COc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Oc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Oc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
CS(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
O=S(=O)(Nc1ccc2oc(nc2c1)-c1ccccc1)c1ccccc1
Fc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Clc1ccccc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Clc1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
FC(F)(F)c1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
[O-][N+](=O)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Cc1ccccc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Cc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
CCc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
COc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Oc1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Oc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
CS(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(C)(=O)=O)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc4ccccc34)ccc2o1)c1cccc2ccccc12
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccccc2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2cccc3nonc23)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(C=C)cc3)ccc2o1
COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
Clc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
C=Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Clc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
C=Cc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccc(NS(=O)(=O)c3ccc(C)cc3)cc2[nH]1
Clc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)cc3)ccc2o1
Brc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Br)cc3)ccc2o1
FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(c3)C(F)(F)F)ccc2o1
Oc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3O)ccc2o1
[O-][N+](=O)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(c3)[N+]([O-])=O)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3C#N)ccc2o1)c1ccccc1C#N
COC(=O)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(cc3)C(=O)OC)ccc2o1
FC(F)(F)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)C(F)(F)F)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4nsnc4c3)ccc2o1)c1ccc2nsnc2c1
O=c1ccc2cc(ccc2o1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4oc(=O)ccc4c3)ccc2o1
NCc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
FC(F)(F)c1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc3ncsc3c2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2cccc3ccccc23)cc1
CCc1ccc(cc1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
FC(F)(F)c1cc(ccc1Cl)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4ccccc4c3)ccc2o1
Fc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Clc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Clc1ccc(cc1Cl)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Cc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
COc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Oc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
Fc1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Fc1ccc(cc1C(F)(F)F)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Cc1cccc(c1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Oc1ccccc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1
Clc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(Cl)c3)ccc2o1
COc1cccc(c1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc(OC)c3)ccc2o1
COC(=O)c1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3C(=O)OC)ccc2o1
O=S(=O)(Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3cccc4nsnc34)ccc2o1)c1cccc2nsnc12
COc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(Cl)s3)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccccc3)ccc2o1
Clc1ccc(s1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc4oc(=O)ccc4c3)ccc2o1
FC(F)(F)c1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
COc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2ccccc2o1
FC(F)(F)c1ccccc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
COc1ccccc1S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccccc1
Clc1ccc(s1)S(=O)(=O)Nc1ccc2oc(nc2c1)-c1ccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1
O=S(=O)(Nc1ccc(cc1)-c1nc2ccccc2o1)c1cccs1
O=S(=O)(Nc1ccc2oc(nc2c1)-c1ccccc1)c1cccs1
C[C@@H]1C(=O)N\C(=C/c2ccccc2)c2nc3c(O)cccc3c(=O)n12 |r|
CC[C@@H](C)C1=C2N=C3OC=CC=C[C@]3(OC)C(=O)N2[C@@H](Cc2ccccc2)C(=O)N1 |r,c:4,9,11,t:6|
C[C@@H]1C(=O)N[C@](O)(Cc2ccccc2)c2nc3OC=CC=Cc3c(=O)n12 |r,c:19,21|
OC(=O)[C@@H](Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1c2c3ccccc3oc2c(Br)c2ccccc12
OC(=O)COc1c(Br)cc(cc1Br)-c1c2c(sc3ccccc23)c(Br)c2ccccc12
OC(=O)[C@@H](Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1c2c3ccccc3sc2c(Br)c2ccccc12
OP(O)(=O)COc1c(Br)cc(cc1Br)-c1c2c3ccccc3sc2c(Br)c2ccccc12
OC(=O)[C@@H](CCN1C(=O)c2ccccc2C1=O)Oc1c(Br)cc(cc1Br)-c1c2c3ccccc3sc2c(Br)c2ccccc12
Oc1c(Br)cc(cc1Br)-c1c2c3ccccc3sc2c(Br)c2ccccc12
COc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2Br)cc1
CCOc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2Br)cc1
Oc1cc(C=O)cc(Br)c1O
CC(C)c1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2)cc1
COc1ccc(cc1)-c1cnc(o1)-c1cc(O)c(O)c(Br)c1
Oc1cc(C=O)c(Br)c(Br)c1O
Cc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2Br)cc1
Oc1cc(-c2ncc(o2)-c2ccc(Oc3ccccc3)cc2)c(Br)c(Br)c1O
COCCc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2)cc1
COc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2)cc1
Oc1cc(-c2ncc(o2)-c2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)c(Br)c(Br)c1O
Oc1cc(cc(Br)c1O)-c1ncc(o1)-c1ccc(Oc2ccc(cc2)-c2ccccc2)cc1
CC(C)c1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2Br)cc1
Oc1cc(cc(Br)c1O)-c1ncc(o1)-c1ccc(Oc2ccccc2)cc1
Oc1cc(-c2ncc(o2)-c2ccc(OCc3ccccc3)cc2)c(Br)c(Br)c1O
Oc1cc(cc(Br)c1O)-c1ncc(o1)-c1ccc(OCc2ccccc2)cc1
COc1ccc(cc1Br)-c1cnc(o1)-c1cc(O)c(O)c(Br)c1
Oc1cc(-c2ncc(o2)-c2ccccc2)c(Br)c(Br)c1O
CCOc1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2)cc1
CC(C)(C)c1ccc(Oc2ccc(cc2)-c2cnc(o2)-c2cc(O)c(O)c(Br)c2)cc1
COc1ccc(cc1Br)-c1cnc(o1)-c1cc(O)c(O)c(Br)c1Br
Oc1cc(cc(Br)c1O)-c1ncc(o1)-c1ccccc1
[H][C@]12Cc3c([nH]c4ccccc34)[C@]1(C)[C@@]1(C)CCC(=O)[C@@]3([H])[C@]4([H])CC(C)(C)[C@@H](O)[C@]4(O)O[C@@]13CC2 |r|
[H][C@]12Cc3c([nH]c4ccccc34)[C@]1(C)[C@@]1(C)CC[C@]3([H])OCC(=O)C=C3[C@]1(O)CC2 |r,c:27|
[H][C@@]12CC[C@@]3(O)C4=CC(=O)[C@H](O[C@@]4([H])CC[C@]3(C)[C@@]1(C)c1[nH]c3ccccc3c1C2=O)C(C)(C)O |r,t:6|
[H][C@]12Cc3c([nH]c4ccccc34)[C@]1(C)[C@@]1(C)CC[C@]3(O)O[C@@H](C(=O)C=C3C1=CC2)C(C)(C)O |r,c:27,31|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)cc2nc3CCCn3c12 |r,t:4|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)cc2[nH]c(=O)oc12 |r,t:4|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)cc2nc3CCCn3c12 |r|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)cc2ncoc12 |r,t:4|
CCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2cc(Cl)cc(Cl)c2)c1
CCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(Oc2ccc(C)cc2)c1
C\C(Cn1oc(=O)[nH]c1=O)=C/c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
CCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(Oc2ccccc2)c1
CCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(Oc2cc(Cl)cc(Cl)c2)c1
CCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2nc(oc2-c2ccccc2)-c2ccc(cc2)C(F)(F)F)c1
CCCCCCCC\C(=C\Cn1oc(=O)n(CC(O)=O)c1=O)c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
C\C(=C/Cn1cc(O)[nH]c1=O)c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
Cc1oc(nc1COc1cccc(c1)C(=C\Cn1oc(=O)[nH]c1=O)\c1ccc(Cl)cc1)-c1ccc(cc1)C(F)(F)F
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2nc(oc2-c2ccccc2)-c2ccc(cc2)C(F)(F)F)c1
CCCC\C(=C/Cn1oc(=O)n(CC(O)=O)c1=O)c1cccc(Oc2cc(Cl)cc(Cl)c2)c1
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2coc(n2)-c2ccc(cc2)C(F)(F)F)c1
Cc1oc(nc1COc1cccc(c1)C(=C\Cn1oc(=O)[nH]c1=O)\C(C)(C)C)-c1ccc(cc1)C(F)(F)F
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2ccccn2)c1
CCCC\C(=C/Cn1oc(=O)n(CC(O)=O)c1=O)c1cccc(OCc2cc(Cl)cc(Cl)c2)c1
CCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(Oc2ccc(OC)cc2)c1
Cc1oc(nc1COc1cccc(c1)C(=C\Cn1oc(=O)n(CC(O)=O)c1=O)\c1ccccc1)-c1ccc(cc1)C(F)(F)F
C\C(=C/Cn1oc(=O)[nH]c1=O)c1ccccc1OCc1nc(oc1C)-c1ccc(cc1)C(F)(F)F
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2ccc3c(Cl)cccc3c2)c1
C\C(=C/Cn1oc(=O)[nH]c1=O)c1ccc(OCCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)cc1
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
CCCCCCCC\C(=C/Cn1oc(=O)n(CC(O)=O)c1=O)c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
CCCCc1oc2ccccc2c1COc1cccc(c1)C(\C)=C\Cn1oc(=O)[nH]c1=O
C\C(=C/Cn1sc(=O)[nH]c1=O)c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCCc2nc(oc2C)-c2ccccc2)c1
C\C(=C/Cc1oc(=O)[nH]c1O)c1cccc(OCc2nc(oc2C)-c2ccc(OC(F)(F)F)cc2)c1
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(COc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
Cc1oc(nc1COc1cccc(c1)C(=C\Cn1oc(=O)[nH]c1=O)\c1ccc(F)cc1)-c1ccc(cc1)C(F)(F)F
CCCCc1oc2ccccc2c1Cc1cccc(c1)C(\C)=C\Cn1oc(=O)[nH]c1=O
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCC#Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
C\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2noc(n2)-c2ccccc2)c1
CC(=CCc1nnn[nH]1)c1cccc(OCc2nc(oc2C)-c2ccc(OC(F)(F)F)cc2)c1 |w:2.2|
[H][C@@]12[C@H](O)C[C@](C)(OC=C1C(=O)OC)[C@H]2CO |r,c:8,THB:10:9:14:4.2,3:2:14:9.8.7,15:14:9.8.7:4.2|
[H][C@@]12CCOC(=O)C1=C(C)C[C@H]2O |r,t:8|
[H][C@]1([C@H](CO)C(=O)OC)[C@H](O)CC(C)=C1CO |r,c:13|
[H][C@]12[C@H](O)C=C(C)[C@@]1(CO)OC(=O)[C@@H]2CO |r,t:4|
[H][C@]12[C@H](O)CC(C)=C1COC(=O)[C@H]2CO |r,c:6|
[H][C@]12[C@H](O)CC(C)=C1COC(=O)[C@@H]2CO |r,c:6|
COC(=O)C1=C(C)C[C@@H](O)[C@@H]1CCO |r,c:4|
[H][C@]12[C@H](O)CC(C)=C1C(=O)OC[C@@H]2C(=O)OC |r,c:6|
CC1=C(CO)[C@@H](CCO)[C@H](O)C1 |r,c:1|
[H][C@]1([C@@H](CO)C(=O)OC)[C@H](O)CC(C)=C1CO |r,c:13|
[H][C@]1([C@H](CO)C(=O)OC)[C@H](O)CC(C)=C1C(=O)OC |r,c:13|
[H][C@]12CC(C)(C)[C@]1([H])CCC(=C)[C@@H](O)CC[C@@]21C[C@H](c2ccccc2)c2c(O)c(C=O)c(O)c(C=O)c2O1 |r|
[H][C@]12CC(C)(C)[C@]1([H])CCC(=C)[C@H](O)CC[C@@]21C[C@H](c2ccccc2)c2c(O)c(C=O)c(O)c(C=O)c2O1 |r|
[H][C@]12C[C@@]3(O)[C@H](C)CC[C@@H](C(C)C)C3=C[C@@]1(C)Oc1c(C=O)c(O)c(C=O)c(O)c1[C@H]2c1ccccc1 |r,c:14|
[H][C@]12C[C@@]3(O)[C@H](c4ccccc4)c4c(O)c(C=O)c(O)c(C=O)c4O[C@]3(C)C=C1[C@@H](CC[C@H]2C)C(C)C |r,c:30|
[H][C@@]12CCC(=C)[C@@H](O)CC[C@]3(C)[C@@H](c4ccccc4)c4c(O)c(C=O)c(O)c(C=O)c4O[C@@]3([H])[C@]1([H])C2(C)C |r|
[H][C@@]12O[C@]3(C[C@]4([H])[C@H](C)CC[C@@H](C(C)C)[C@@]14O)[C@H](c1ccccc1)c1c(O)c(C=O)c(O)c(C=O)c1O[C@]23C |r|
[H][C@]12CC(C)(C)[C@]1([H])C\C=C(C)/[C@H](O)CC[C@@]21C[C@H](c2ccccc2)c2c(O)c(C=O)c(O)c(C=O)c2O1 |r,t:10|
[H][C@]12C[C@]34O[C@]3([C@@H](CC[C@H]4C)C(C)C)[C@H](O)[C@@]1(C)Oc1c(C=O)c(O)c(C=O)c(O)c1[C@H]2c1ccccc1 |r|
[H][C@@]12C\C=C(C)/[C@@H](O)CC[C@]3(C)[C@@H](c4ccccc4)c4c(O)c(C=O)c(O)c(C=O)c4O[C@@]3([H])[C@]1([H])C2(C)C |r,t:3|
[H][C@@]12CCC(=C)[C@H](O)CC[C@]3(C)[C@@H](c4ccccc4)c4c(O)c(C=O)c(O)c(C=O)c4O[C@@]3([H])[C@]1([H])C2(C)C |r|
CCCCc1oc2ccccc2c1Cc1ccc2cc(O)ccc2c1
CCCCc1oc2ccccc2c1Cc1ccc2c(Br)c(OCC(O)=O)ccc2c1
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1[N+]([O-])=O)-c1ccc(cc1)-c1c(oc2ccccc12)C(=O)c1ccccc1
OC(=O)C(Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CCCCc1oc2ccccc2c1Cc1ccc(cc1)-c1ccc(OCn2cnnn2)cc1
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1[N+]([O-])=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(oc2ccccc12)C(=O)c1ccccc1
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccn2)sc2ccccc12
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)COc1ccc(cc1-c1ccccc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CCCCc1oc2ccccc2c1-c1ccc(cc1)-c1ccc(OC(Cc2ccccc2)C(O)=O)cc1
OC(=O)CCNc1cc(ccc1OCCc1ccccc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
COc1cc(cc(OC)c1OC)-c1cc(ccc1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1cc(cc(C)c1OS(=O)(=O)c1ccc(C(O)=O)c(O)c1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1oc(nc1-c1ccc(cc1)-c1ccc(OCn2cnnn2)cc1)-c1ccc(cc1)C(F)(F)F
CC1(C)Oc2ccc(Cc3sc4ccccc4c3-c3ccc(cc3)-c3ccc(OC(Cc4ccccc4)C(O)=O)cc3)cc2O1
COc1cccc(c1OC)-c1cc(ccc1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1sc(Cc2ccccc2)c(c1C)-c1ccc(cc1)-c1ccc(OC(Cc2ccccc2)C(O)=O)cc1
CCCCc1oc2ccccc2c1C(O)c1ccc(cc1)-c1cc(Br)c(O)c(Br)c1
Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)COc1ccc(cc1C1CCCC1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
Cc1cc(cc(C)c1OC(Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)c1cc(ccc1O)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccc(O)cc2O)sc2ccccc12
CCCCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(OC(Cc2ccccc2)C(O)=O)cc1
CCCCC(Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
CCCCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(O)cc1
OC(=O)\C=C/C(=O)Nc1cc(ccc1O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CCCCc1oc2ccccc2c1C(O)c1ccc(cc1)-c1ccc(OCC(O)=O)cc1
CCC(Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
CCCCc1oc2ccccc2c1C(=O)c1ccc2c(Br)c(OC(Cc3ccccc3)C(O)=O)ccc2c1
OC(=O)C(CCN1C(=O)c2ccccc2C1=O)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(CCNC(=O)c1ccccc1C(O)=O)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1oc(nc1-c1ccc(cc1)-c1cc(Br)c(OC(Cc2ccccc2)C(O)=O)c(Br)c1)-c1ccc(cc1)C(F)(F)F
CCCCc1oc2ccccc2c1-c1ccc(cc1)-c1ccc(OCC(O)=O)cc1
OC(=O)C(CCc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1C1CCCC1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)COc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ncccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccc(F)cc12
Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(c1oc2ccccc2c1-c1ccc(cc1)-c1ccc(OC(Cc2ccccc2)C(O)=O)cc1)c1ccccc1
OC(=O)CNc1cc(ccc1OCCc1ccccc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
COc1ccc(cc1)-c1cc(ccc1OC(Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)CCC(=O)Nc1cc(ccc1O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CC(Cc1ccccc1)(Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
CCCCc1oc2ccccc2c1Cc1ccc2c(Br)c(OCn3cnnn3)ccc2c1
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1oc2ccccc2c1Cc1ccccc1
Cc1ccc2oc(Cc3ccccc3)c(-c3ccc(cc3)-c3ccc(OC(Cc4ccccc4)C(O)=O)cc3)c2c1
OC(=O)c1cccc(c1)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CCCCc1oc2ccccc2c1C(=O)c1ccc2c(Br)c(OCn3cnnn3)ccc2c1
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1coc2ccccc12
COc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(OC(Cc3ccccc3)C(O)=O)cc2)cc1OC
Cc1oc(nc1-c1ccc(cc1)-c1ccc(OC(Cc2ccccc2)C(O)=O)cc1)-c1ccc(cc1)C(F)(F)F
COc1ccc(cc1)-c1cc(ccc1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
CCCCc1oc2ccccc2c1Cc1ccc(cc1)-c1ccc(O)cc1
OC(=O)C(CCN1C(=O)c2ccccc2C1=O)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1oc(nc1-c1ccc(cc1)-c1ccc(OCC(O)=O)cc1)-c1ccc(cc1)C(F)(F)F
COc1ccc(cc1)-c1cc(cc(-c2ccc(OC)cc2)c1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)C(Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)c1ccccc1
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccc(F)cc2)sc2ccccc12
Cc1sc(Cc2ccccc2)c(c1C)-c1ccc(cc1)-c1ccc(OS(=O)(=O)c2ccc(C(O)=O)c(O)c2)cc1
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
CC(C)CC(Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
OC(=O)C(CCc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CCCCc1oc2ccccc2c1C(O)c1ccc2cc(O)ccc2c1
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1C1CCCC1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
COc1ccc(cc1)-c1cc(cc(Br)c1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
Cc1oc(nc1-c1ccc(cc1)-c1cc(Br)c(O)c(Br)c1)-c1ccc(cc1)C(F)(F)F
OC(=O)COc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
CCCCc1oc2ccccc2c1Cc1ccc2c(Br)c(OC(Cc3ccccc3)C(O)=O)ccc2c1
COC(=O)C(CCNC(=O)c1ccccc1C(O)=O)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1oc(nc1-c1ccc2c(Br)c(OCC(O)=O)ccc2c1)-c1ccc(cc1)C(F)(F)F
CCCCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(OC(C(O)=O)c2ccccc2)cc1
CC(Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
OC(=O)CCCOc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
COc1cccc(c1)-c1cc(cc(-c2cccc(OC)c2)c1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2nccs2)sc2ccccc12
CCOc1ccc(cc1)-c1cc(ccc1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1C1CCCC1)-c1ccc(cc1)-c1c(oc2ccccc12)C(=O)c1ccccc1
COc1cccc(c1)-c1cc(cc(Br)c1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
CCCCc1oc2ccccc2c1-c1ccc(cc1)-c1ccc(O)cc1
Oc1ccc(cc1)-c1ccc(cc1)-c1c(oc2ccccc12)C(=O)c1ccccc1
COc1ccc(cc1)-c1cc(ccc1OC(Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
CCCCc1oc2ccccc2c1Cc1ccc2c(I)c(O)ccc2c1
COc1ccc(c(OC)c1)-c1cc(cc(Br)c1OCC(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Oc1c(I)cc(cc1I)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
COc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(OC(Cc3ccccc3)C(O)=O)cc2)c(OC)c1
CCCCc1oc2ccccc2c1Cc1ccc(cc1)-c1ccc(OCC(O)=O)cc1
OC(=O)c1ccccc1C(=O)Nc1cc(ccc1O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
COc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(OC(Cc3ccccc3)C(O)=O)cc2)cc1
CCCCCCC(Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
OC(=O)c1ccc(cc1O)S(=O)(=O)Oc1ccc(cc1[N+]([O-])=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1ccsc1Cc1ccccc1
Cc1oc(nc1-c1cccc(c1)-c1ccc(OC(Cc2ccccc2)C(O)=O)cc1)-c1ccc(cc1)C(F)(F)F
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccc(O)cc2O)sc2ccccc12
Cc1oc(nc1-c1ccc(cc1)-c1cc(Br)c(OCC(O)=O)c(Br)c1)-c1ccc(cc1)C(F)(F)F
OC(=O)c1ccc(cc1)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)c1ccc(COc2ccc(cc2)-c2ccc(cc2)-c2c(Cc3ccccc3)oc3ccccc23)cc1
CCCCc1oc2ccccc2c1C(O)c1ccc2c(Br)c(O)ccc2c1
CC(=O)Oc1cc(ccc1C(O)=O)S(=O)(=O)Oc1ccc(cc1)-c1ccc(cc1)-c1coc2ccccc12
CCCCc1oc2ccccc2c1C(O)c1ccc(cc1)-c1ccc(O)cc1
Oc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(O)cc2)cc1
CCCCc1oc2ccccc2c1Cc1ccc2c(I)c(OC(Cc3ccccc3)C(O)=O)ccc2c1
CCCCc1oc2ccccc2c1Cc1ccc2c(Br)c(O)ccc2c1
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
OC(=O)[C@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc4ccccc4c3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)(C)C)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)(C)C)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)C)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)C)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccccc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)Nc2ccc(Oc3ccc(cc3)C(C)C)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)Nc2ccccc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)c2ccc(Oc3ccc(cc3)C(C)C)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(Cl)cc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(Br)cc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc4ccccc4c3)cc2)cc1 |r|
CCCCCCCCCCc1ccc(NC(=O)C(=O)N2C[C@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCCCCCCCCCCCc1ccc(NC(=O)C(=O)N2C[C@@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(Cc3ccccc3)C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CNC[C@@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(Cc3ccc(Oc4ccc(cc4)C(C)C)cc3)C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCCCCCc1ccc(NC(=O)C(=O)N2C[C@@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CNC[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(F)cc3)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)c2ccc(Oc3ccccc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(F)cc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(Br)cc3)cc2)cc1 |r|
CCCCCCc1ccc(NC(=O)C(=O)N2C[C@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(Cc3ccc(Oc4ccccc4)cc3)C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(CC)cc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(CC)cc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccccc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)c2ccccc2)cc1 |r|
CCCCCCCCCCc1ccc(NC(=O)C(=O)N2C[C@@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCCCCCCCCCCCc1ccc(NC(=O)C(=O)N2C[C@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1 |r|
CCOS(=O)(=O)\C=C\c1ccc(O[C@@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1 |r|
CCOS(=O)(=O)CCc1ccc(O[C@H]2CN(C[C@H]2Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)C(=O)C(=O)Nc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)cc1 |r|
Oc1c2cc(CP(O)(=O)c3ccccc3)cc1sc1cc(CP(O)(=O)c3ccccc3)cc(sc3cc(CP(O)(=O)c4ccccc4)cc(sc4cc(CP(O)(=O)c5ccccc5)cc(s2)c4O)c3O)c1O
Oc1c2Cc3cc(CP(O)(=O)c4ccccc4)cc(Cc4cc(CP(O)(=O)c5ccccc5)cc(Cc5cc(CP(O)(=O)c6ccccc6)cc(Cc1cc(CP(O)(=O)c1ccccc1)c2)c5O)c4O)c3O
Oc1c2cc(CP(O)(=O)c3ccccc3)cc1S(=O)(=O)c1cc(CP(O)(=O)c3ccccc3)cc(c1O)S(=O)(=O)c1cc(CP(O)(=O)c3ccccc3)cc(c1O)S(=O)(=O)c1cc(CP(O)(=O)c3ccccc3)cc(c1O)S2(=O)=O
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(cc1)-n1cccn1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OCC=C)cc1OC
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OCCCCC(O)=O)cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(cc1)N(CC=C)CC=C
COc1ccc(cc1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
COc1cc(O)c(cc1\C=C\C(=O)c1ccc(O)cc1)[C@@H](C)C(C)=C |r|
COc1cc(O)c(cc1\C=C\C(=O)c1ccc(O)cc1)C(C)(C)C=C
CCOC(=O)CCCCOc1ccc(cc1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
CCOC(=O)CCCOc1ccc(cc1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OC(=O)c2ccc(Br)cc2)cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OC(=O)c2ccccc2)cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1cccc(c1)N(CC=C)CC=C
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1cc2OCOc2cc1N(C)C
CC(C)Oc1cc(O)c(CC=C)cc1\C=C\C(=O)c1cccc(c1)N(C)C
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccccc1N(C)C
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1cccc(c1)N(C)C
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1cccc(c1)N1CCCCC1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccccc1N1CCCCC1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(cc1)N1CCCCC1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OC)c(c1)C(C)C(C)=C
COc1ccc(cc1CC=C)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
[#6]-[#8]-c1cc(-[#8])c(-[#6]-[#6]=[#6])cc1\[#6]=[#6]\[#6](=O)-c1ccc(-[#8]-[#6]\[#6]=[#6](/[#6])-[#6])cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OCC=C)cc1
COc1ccc(C(=O)\C=C\c2cc(CC=C)c(O)cc2OC)c(O)c1
COc1cc(OC2CCCCO2)c(CC=C)cc1\C=C\C(=O)c1ccc(O)cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(O)cc1
CCOc1ccc(cc1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OCCCC(O)=O)cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OCC(O)=O)cc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(cc1)N(C)C
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OCC=C)cc1O
CCOC(=O)COc1ccc(cc1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(OC(=O)c2ccc(cc2)C(C)(C)C)cc1
CN(C)c1cccc(c1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OCc1ccccc1
COc1cc(O)c(CC=C)cc1\C=C\C(=O)c1ccc(cc1)N1CCOCC1
[#6]-[#8]-c1ccc(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6](=O)\[#6]=[#6]\c1cc(-[#6]-[#6]=[#6])c(-[#8])cc1-[#8]-[#6]
[#6]-[#8]-c1cc(-[#8])c(-[#6]-[#6]=[#6])cc1\[#6]=[#6]\[#6](=O)-c1ccc(-[#8]-[#6]\[#6]=[#6](/[#6])-[#6])cc1-[#8]
COc1cccc(c1)C(=O)\C=C\c1cc(CC=C)c(O)cc1OC
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(C(O)=O)c(O)c1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CC(O)=O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(C(O)=O)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(C(O)=O)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(O)c(c1)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)c(OCC(O)=O)c1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CC(O)=O)c(O)c1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OP(O)(O)=O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
CCCCCCCCCCCCCC[C@@H](OP(O)(O)=O)[C@@H](O)CCCO |r|
OCCC[C@@H](O)CCCCCCC(=O)NCC(O)=O |r|
CCCCCCCCCCCCCC[C@@H](OP(O)(O)=O)[C@@H](O)CC[C@@H](O)[C@@H](O)CC[C@@H](O)CCCCCCC(=O)NCC(O)=O |r|
C[C@@H](Oc1c(I)cc(cc1I)-c1c2c(C)c(C)oc2cc2sc3ccccc3c12)C(O)=O
Cc1oc2cc3sc4ccccc4c3c(-c3cc(I)c(O[C@H](Cc4ccccc4)C(O)=O)c(I)c3)c2c1C
OC(=O)[C@@H](Cc1ccccc1)Oc1c(I)cc(cc1I)-c1c2c(cc3ccccc13)sc1ccccc21
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(F)cc1)C(C)(C)C |r,t:4|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(cc1)C(F)(F)F)C(C)C |r,t:5|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(Cl)cc1)C(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(Br)cc1)C(C)(C)C |r,t:4|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(Br)cc1)C(C)C |r,t:5|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(F)cc1)C(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(cc1)C(F)(F)F)C(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccccc1)C(C)(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(Cl)cc1)C(C)(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(cc1)C(F)(F)F)C(C)(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(C)cc1)C(C)(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(OC)cc1)C(C)(C)C |r,t:4|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccccc1)C(C)C |r,t:5|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(cc1)[N+]([O-])=O)C(C)C |r,t:5|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(C)cc1)C(C)C |r,t:5|
COC(CC(C)C)c1ccc2ccc(-c3ccc(CC(Cc4ccc(cc4)C(F)(F)P(O)(O)=O)(c4ccccc4)n4nnc5ccccc45)cc3)c(c2n1)P(O)(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](CCSC)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CC(C)OCc1cc(O)c(O)c(Br)c1Cc1cc(O)c(O)c(Br)c1Br
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(Cl)cc1)C(C)C |r,t:5|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccccc1)C(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(cc1)[N+]([O-])=O)C(C)C |r,t:4|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(cc1)[N+]([O-])=O)C(C)(C)C |r,t:4|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(F)cc1)C(C)C |r,t:5|
CCOC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(OC)cc1)C(C)C |r,t:5|
COC(=O)C1=C(NC(=S)N[C@H]1\C=C\c1ccc(Br)cc1)C(C)C |r,t:4|
N=C1c2sc(cc2C(=O)NC1=O)-c1ccccc1
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
[H][C@]1(CC[C@@H](C)c2c(O)cc(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)COC(=O)\C=C\c1ccccc1 |r|
[H][C@]1(CC[C@@H](C)c2c(O)c(O)c(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)COC(=O)CCC |r|
[H][C@]1(CC[C@@H](C)c2c(O)c(O)c(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)COC(=O)CC(C)C |r|
C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O |r,t:3|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@](C)(CC1=C(O)C(=O)C=C(CCCS(O)(=O)=O)C1=O)[C@@H]2C |r,c:15,t:4,20|
[H][C@@]1(O[C@H]2[C@H](O)C[C@@H](O)c3ccccc23)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
Oc1ccc-2c(c1)[C@@H]1Oc3ccccc3[C@H]3CC(=O)c4c(O)cc(O)c-2c4[C@@H]13 |r|
Oc1ccc-2c(c1)[C@@H]1Oc3ccccc3[C@@]3(O)CC(=O)c4c(O)cc(O)c-2c4[C@@H]13
O[C@@H]1[C@H]2[C@@H]3[C@@H](Oc4ccccc24)c2cccc(O)c2-c2c(O)cc(O)c(C1=O)c32
[H][C@@]12[#6]-[#6]-[#6](=[#6])[C@]1([H])[C@@]1([H])[C@]([H])([#6]-[#6][C@@]21[#6])[#6](-[#6])-[#6]-[#6](=O)\[#6]=[#6](\[#6])-[#6] |r|
[H][C@]1(CC[C@@H](C)c2c(O)c(O)c(cc12)C(O)=O)[C@@H](C)CCC[C@@H](C)CO |r|
[H][C@]12[#6]-[#6@H](-[#6]-[#6][C@]1([#6])[#6]-[#6]-[#6]-[#6]2=[#6])-[#6](=[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r|
[H][C@@]12CC(=O)c3c(O)cc(OC)c4-c5ccc(O)cc5[C@]([H])(Oc5ccccc15)[C@]2([H])c34 |r|
OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2[C@@H]2[C@H](Oc3cc(O)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(\C=C\c4ccc(O)cc4)c23)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc3O[C@@H]([C@H](c3c2)c2cc(O)cc(O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Oc1ccc(cc1)[C@H]1Oc2ccc(\C=C\c3cc(O)cc(O)c3O)cc2[C@@H]1c1cc(O)cc(O)c1O |r|
OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc3O[C@H]([C@@H](c3c2)c2cc(O)cc(O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Oc1ccc(cc1)[C@@H]1Oc2ccc(\C=C\c3cc(O)cc(O)c3O)cc2[C@H]1c1cc(O)cc(O)c1O |r|
CC(=O)O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@@H]1O |r|
COc1cc(\C=C\C(=O)O[C@H]2[C@H](O)[C@@H](CO)O[C@@H](Oc3c(O)cc(O)cc3\C=C\c3ccc(O)cc3)[C@@H]2O)ccc1O |r|
O[C@@H]1[C@@H](COC=O)O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@H](O)[C@H]1O |r|
COc1cc(ccc1O)[C@@H]1CC(=O)Oc2cc(O)c(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(\C=C\c3ccc(O)cc3)c12 |r|
OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
Oc1ccc(\C=C\c2cc(O)cc(O)c2O)cc1
OC[C@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(O)cc(O)cc3\C=C\c3ccc(O)cc3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O |r|
CC(=O)OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O |r|
OC[C@H]1O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](O)[C@@H]1O |r|
COc1cc(\C=C\C(=O)O[C@H]2[C@H](Oc3c(O)cc(O)cc3\C=C\c3ccc(O)cc3)O[C@H](CO)[C@@H](O)[C@@H]2O)ccc1O |r|
c1cc(ccc1\C=C\c2cc(cc(c2)O)O)O
O[C@@H]1CO[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@H](O)[C@H]1O |r|
C[C@@H]1O[C@@H](Oc2c(O)cc(O)cc2\C=C\c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O |r|
OC(=O)c1cc(O)cc(O)c1C(=O)Cc1ccc(O)cc1
CSc1ccnc(CS(=O)c2nc3ccc(OC(C)C)cc3[nH]2)c1
O[V](=O)=O
O[C@@H]1Cc2c(O)cc3OC(=O)[C@@]4([C@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1 |r|
O[C@@H]1Cc2c(O)cc3OC(=O)[C@]4([C@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1 |r|
O[C@H]1Cc2c(O)cc3OC(=O)[C@@]4([C@@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1 |r|
O[C@H]1Cc2c(O)cc3OC(=O)[C@@]4([C@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1 |r|
O[C@H]1Cc2c(O)cc3OC(=O)[C@]4([C@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1 |r|
O[C@H]1Cc2c(O)cc3OC(=O)[C@]4([C@@H](Oc5cc(O)cc(O)c45)c4ccc(O)cc4)c3c2O[C@@H]1c1ccc(O)cc1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc2-[#8]-[#6][C@@]([#8])([#6](=O)-c2c1-[#8])c1ccc(-[#8])c2-[#6]=[#6]C([#6])([#6])[#8]-c12 |r,c:27|
[#6]-[#8]-c1cc2-[#8]-[#6]-[#6@H](-[#6]-c2c(-[#8]-[#6])c1-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8])c(-[#6]-[#6@H](-[#8])-[#6](-[#6])=[#6])c1-[#8] |r|
[#6]-[#8]-c1cc(-[#8])ccc1-c1cc2c(-[#8]-[#6])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2o1
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8]-[#6]-[#6@H](-[#6]-c12)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8] |r|
[H][C@@]12[#6]-[#8]-c3cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8]-[#6])c3[C@]1([H])[#8]-c1cc3-[#8]C([#6])([#6])[#6]=[#6]-c3cc21 |r,c:30|
[#6]-[#8]-c1cc2-[#8]-[#6]-[#6@H](-[#6]-c2c(-[#8]-[#6])c1-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8])c2-[#6]=[#6]C([#6])([#6])[#8]-c12 |r,c:27|
[H][C@@]12[#6]-[#8]-c3cc(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8]-[#6])c3[C@]1([H])[#8]-c1cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])cc21 |r|
[#6]-[#8]-c1cc2-[#8]-[#6]-[#6](-[#6](=O)-c2c(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2occ(-c3ccc(-[#8])cc3)c(=O)c2c1-[#8]
[#6]-[#8]-c1cc2oc(cc2c(-[#8]-[#6])c1-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8])cc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-c2cc3ccc(-[#8])cc3o2)c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1coc2cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c1=O
[#6]-[#8]-c1c(oc2cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c1=O)-c1ccc(-[#8])cc1
[#6]-[#8]-c1cc2occ(-c3ccc(-[#8])cc3-[#8])c(=O)c2c(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2-[#8]-1
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc2-[#8]-[#6]-c3c(oc4cc(-[#8])ccc34)-c12
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(c1-[#8])-c1coc2cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c1=O
[#6]\[#6](-[#6])=[#6]\[#6]-c1ccc(-[#8])c2c1oc1c(-[#8])c(-[#6])cc(-[#8])c1c2=O
COC1CCC(=O)c2c(O)c(cc(O)c12)-c1cc(O)c2C(CCC(=O)c2c1O)OC
[H][C@]12C[C@]3(c4ccccc4N[C@@]3([H])N1C(=O)[C@@]1([H])C[C@]3(c4ccccc4N[C@@]3([H])N1C2=O)C(C)(C)C=C)C(C)(C)C=C |r|
CC1(c2c(c3cc(c(cc3[nH]2)Cl)Cl)C[C@]45[C@H]1C[C@@]6(CCCN6C4)C(=O)N5)C
FC(F)(F)c1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1
Cc1sc(NS(=O)(=O)\C=C\c2ccc(F)c(F)c2)nc1-c1ccc(Cl)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(cc2)-c2ccccc2)nc1-c1ccc(Cl)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(F)c(F)c2)nc1-c1ccc(cc1)C(F)(F)F
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(C)cc2)nc1-c1ccc(Cl)cc1
COc1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1OC
COC(=O)c1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc3ccccc3c2)nc1-c1ccc2ccccc2c1
CCc1sc(NS(=O)(=O)\C=C\c2ccc(cc2)[N+]([O-])=O)nc1-c1ccccc1
CCc1sc(NS(=O)(=O)\C=C\c2ccc3ccccc3c2)nc1-c1ccccc1
CCCCCCCCCCc1sc(NS(=O)(=O)\C=C\c2ccccc2Cl)nc1-c1ccccc1
Fc1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1F
O=S(=O)(Nc1nc(c(s1)-c1ccccc1)-c1ccccc1)\C=C\c1ccc2ccccc2c1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(cc2)C(F)(F)F)nc1-c1ccc(cc1)-c1ccccc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc3ccccc3c2)nc1-c1ccc(cc1)-c1ccccc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccccc2Cl)nc1-c1ccc(cc1)C(F)(F)F
Cc1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccccc2Cl)nc1-c1ccc(cc1)-c1ccccc1
O=S(=O)(Nc1nc(c(s1)-c1ccccc1)-c1ccccc1)\C=C\c1ccc(cc1)-c1ccccc1
CCc1sc(NS(=O)(=O)\C=C\c2ccc(cc2)S(C)(=O)=O)nc1-c1ccccc1
Clc1ccccc1\C=C\S(=O)(=O)Nc1nc(c(s1)-c1ccccc1)-c1ccccc1
CCCCCCCCC\C=C\S(=O)(=O)Nc1nc(c(s1)-c1ccccc1)-c1ccccc1
CCc1sc(NS(=O)(=O)\C=C\c2ccccc2Cl)nc1-c1ccccc1
[O-][N+](=O)c1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1
Cc1sc(NS(=O)(=O)\C=C\c2ccccc2Cl)nc1-c1ccc(Cl)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccccc2Cl)nc1-c1ccc(Cl)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(C)cc2)nc1-c1ccc(cc1)C(F)(F)F
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(F)c(F)c2)nc1-c1ccc(Cl)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(C)cc2)nc1-c1ccc(cc1)-c1ccccc1
O=S(=O)(Nc1nc(c(s1)-c1ccccc1)-c1ccccc1)\C=C\c1ccco1
Clc1ccc(cc1)-c1csc(NS(=O)(=O)\C=C\c2ccccc2Cl)n1
CCCCc1ccc(\C=C\S(=O)(=O)Nc2nc(c(CCC)s2)-c2ccc(cc2)-c2ccccc2)cc1
CCCc1sc(NS(=O)(=O)\C=C\c2ccc(F)c(F)c2)nc1-c1ccc(cc1)-c1ccccc1
CCCCc1ccc(\C=C\S(=O)(=O)Nc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1
O=S(=O)(Nc1nc(c(s1)-c1ccccc1)-c1ccccc1)\C=C\c1ccc(cc1)C#N
CCCCCCC\C=C\C(\CO)=C\C=C\C(O)=O
CCCCCCC\C=C\C(\COC(C)=O)=C/C=C/C(O)=O
CCCCCCC\C=C\C(\COC(C)=O)=C\C=C\C(O)=O
CCCCCCC\C=C\C(=C)CCCC(O)=O
CCCCCCC\C=C\C(\C)=C\C=C\C(O)=O
CCCCCCC\C=C\C(\COC(O)=O)=C\[C@@H]1[C@@H](\C=C\C(O)=O)C(COC(C)=O)=C[C@@H](CCCCCCC)[C@H]1C(O)=O |r,c:28|
CCCCCCC[C@@H]1C=C(CO)[C@H](\C=C\C(O)=O)[C@@H]([C@H]1CCCCCCC)C(\COC(C)=O)=C\C=C\C(O)=O |r,t:8|
CCCCCCC[C@@H]1C=C(COC(C)=O)[C@H](\C=C\C(O)=O)[C@@H]([C@H]1CCCCCCC)C(\CO)=C\C=C\C(O)=O |r,t:8|
CCCCCCC[C@@H]1C=C(COC(C)=O)[C@H](\C=C\C(O)=O)[C@H]([C@@H]1CCCCCCC)C(\CO)=C\C=C\C(O)=O |r,t:8|
CCCCCCC[C@@H]1C=C(COC(C)=O)[C@H](\C=C\C(O)=O)[C@@H]([C@H]1CCCCCCC)C(\COC(C)=O)=C\C=C\C(O)=O |r,t:8|
CCCCCCC[C@@H]1C=C(COC(C)=O)[C@H](\C=C\C(O)=O)[C@H]([C@@H]1CCCCCCC)C(\COC(C)=O)=C\C=C\C(O)=O |r,t:8|
Cc1sc2c(Br)c3ccccc3c(-c3cc(C)c(O[C@H](Cc4ccccc4)C(O)=O)c(C)c3)c2c1C
CC(C)[C@@H](CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)NCCCNCCCCNCCCN)OS(O)(=O)=O |r|
CCCCCCCCCCCCCCCCCCCC(=O)O
CCCCCCCCCCCCCCCCCC(=O)O
CCCCCCCCCCCCCCCC(=O)O
CCCCCCCC\C=C/CCCCCCCCCC(O)=O
CCCCCCCC\C=C/CCCCCCCC(=O)O
CCCCCC\C=C/CCCCCCCC(=O)O
COc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(C(=O)c4c(O)cc(O)cc4C3(C)C)c(O)c12 |(33.52,-24.48,;32.19,-25.25,;30.86,-24.48,;30.85,-22.94,;29.52,-22.18,;29.51,-20.64,;28.18,-22.96,;26.84,-22.2,;28.19,-24.49,;26.86,-25.28,;29.53,-25.25,;29.53,-27.66,;28.2,-28.43,;28.2,-29.98,;26.87,-30.74,;29.54,-30.75,;30.87,-29.97,;32.2,-30.73,;33.54,-29.96,;33.53,-28.41,;34.86,-27.63,;34.84,-26.09,;36.2,-28.39,;37.52,-27.61,;37.51,-26.07,;38.87,-28.36,;38.89,-29.91,;40.23,-30.67,;37.55,-30.7,;36.21,-29.94,;34.87,-30.72,;35.63,-32.05,;34.1,-32.04,;32.19,-27.65,;32.18,-26.11,;30.87,-28.42,)|
COc1cc(O)cc(C)c1-c1cc(O)cc2cc3c(C(=O)c4c(O)c(Cl)c(O)cc4C3(C)C)c(O)c12 |(13.3,-23.3,;11.96,-24.07,;10.63,-23.3,;10.63,-21.76,;9.29,-21,;9.28,-19.46,;7.95,-21.78,;7.96,-23.32,;6.64,-24.1,;9.3,-24.07,;9.31,-26.48,;7.98,-27.25,;7.97,-28.8,;6.64,-29.57,;9.31,-29.57,;10.64,-28.79,;11.98,-29.56,;13.31,-28.78,;13.3,-27.23,;14.63,-26.45,;14.62,-24.91,;15.97,-27.21,;17.3,-26.43,;17.28,-24.89,;18.64,-27.18,;19.97,-26.39,;18.66,-28.73,;20,-29.49,;17.33,-29.52,;15.99,-28.76,;14.64,-29.54,;15.41,-30.87,;13.87,-30.86,;11.97,-26.47,;11.96,-24.93,;10.64,-27.25,)|
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(C(=O)c4c(O)cc(O)cc4C3(C)C)c(O)c12 |(75.83,-23.55,;74.5,-24.33,;73.16,-23.56,;73.16,-22.02,;71.82,-21.25,;71.81,-19.71,;70.48,-22.03,;69.15,-21.27,;70.5,-23.57,;69.17,-24.35,;71.83,-24.32,;71.84,-26.74,;70.51,-27.51,;70.51,-29.05,;69.17,-29.82,;71.84,-29.82,;71.84,-31.36,;73.17,-29.04,;74.51,-29.81,;75.84,-29.03,;75.83,-27.49,;77.16,-26.71,;77.15,-25.17,;78.5,-27.46,;79.83,-26.68,;79.81,-25.14,;81.17,-27.43,;81.19,-28.99,;82.53,-29.74,;79.86,-29.77,;78.52,-29.01,;77.18,-29.79,;77.94,-31.12,;76.4,-31.12,;74.5,-26.73,;74.49,-25.19,;73.17,-27.5,)|
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Br)c2cc3c(C(=O)c4c(O)cc(O)cc4C3(C)C)c(O)c12 |(34.31,-40.48,;32.97,-41.25,;31.64,-40.48,;31.64,-38.95,;30.3,-38.18,;30.29,-36.64,;28.96,-38.96,;27.63,-38.2,;28.97,-40.5,;27.65,-41.28,;30.31,-41.25,;30.32,-43.66,;28.99,-44.43,;28.98,-45.98,;27.65,-46.75,;30.32,-46.75,;30.32,-48.29,;31.65,-45.97,;32.99,-46.74,;34.32,-45.96,;34.31,-44.41,;35.64,-43.63,;35.63,-42.09,;36.98,-44.39,;38.31,-43.61,;38.29,-42.07,;39.65,-44.36,;39.67,-45.91,;41.01,-46.67,;38.34,-46.7,;36.99,-45.94,;35.65,-46.72,;36.42,-48.05,;34.88,-48.04,;32.98,-43.65,;32.97,-42.11,;31.65,-44.43,)|
COc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(C(=O)c4c(O)c(Cl)c(O)cc4C3(C)C)c(O)c12 |(55.29,-24.17,;53.95,-24.94,;52.62,-24.17,;52.62,-22.63,;51.28,-21.86,;51.27,-20.32,;49.94,-22.65,;48.61,-21.89,;49.95,-24.18,;48.63,-24.96,;51.29,-24.94,;51.3,-27.35,;49.97,-28.12,;49.96,-29.66,;48.63,-30.43,;51.3,-30.43,;52.63,-29.65,;53.97,-30.42,;55.3,-29.65,;55.29,-28.1,;56.62,-27.32,;56.61,-25.78,;57.96,-28.08,;59.29,-27.29,;59.27,-25.75,;60.63,-28.05,;61.96,-27.26,;60.65,-29.6,;61.99,-30.36,;59.32,-30.38,;57.97,-29.62,;56.63,-30.4,;57.4,-31.73,;55.86,-31.73,;53.96,-27.34,;53.95,-25.8,;52.63,-28.11,)|
COc1cc(O)c(Cl)c(C)c1-c1cc(O)cc2cc3c(C(=O)c4c(O)c(Cl)c(O)c(Cl)c4C3(C)C)c(O)c12 |(11.8,-41.06,;10.47,-41.83,;9.14,-41.06,;9.13,-39.52,;7.8,-38.76,;7.79,-37.22,;6.46,-39.54,;5.12,-38.78,;6.47,-41.07,;5.14,-41.86,;7.81,-41.83,;7.81,-44.24,;6.48,-45.01,;6.48,-46.56,;5.15,-47.32,;7.82,-47.33,;9.15,-46.55,;10.48,-47.31,;11.82,-46.54,;11.81,-44.99,;13.14,-44.21,;13.12,-42.67,;14.48,-44.97,;15.8,-44.19,;15.79,-42.65,;17.15,-44.94,;18.47,-44.15,;17.17,-46.49,;18.51,-47.25,;15.83,-47.28,;15.85,-48.82,;14.49,-46.52,;13.15,-47.3,;13.91,-48.63,;12.38,-48.62,;10.47,-44.23,;10.46,-42.69,;9.15,-45,)|
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(C(=O)c4c(O)c(Cl)c(O)cc4C3(C)C)c(O)c12 |(14.09,-7,;12.76,-7.77,;11.42,-7,;11.42,-5.46,;10.08,-4.7,;10.07,-3.16,;8.75,-5.48,;7.41,-4.72,;8.76,-7.01,;7.43,-7.79,;10.09,-7.77,;10.1,-10.18,;8.77,-10.95,;8.77,-12.49,;7.43,-13.26,;10.1,-13.26,;10.1,-14.8,;11.43,-12.49,;12.77,-13.25,;14.1,-12.48,;14.1,-10.93,;15.42,-10.15,;15.41,-8.61,;16.77,-10.91,;18.09,-10.12,;18.07,-8.58,;19.44,-10.88,;20.76,-10.09,;19.45,-12.43,;20.79,-13.19,;18.12,-13.22,;16.78,-12.45,;15.44,-13.24,;16.2,-14.57,;14.67,-14.56,;12.76,-10.17,;12.75,-8.63,;11.43,-10.94,)|
COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(C(=O)c4c(O)c(Cl)c(O)c(Cl)c4C3(C)C)c(O)c12 |(34.05,-7.29,;32.72,-8.06,;31.39,-7.3,;31.38,-5.76,;30.04,-4.99,;30.04,-3.45,;28.71,-5.77,;27.37,-5.01,;28.72,-7.31,;27.39,-8.09,;30.06,-8.06,;30.06,-10.47,;28.73,-11.25,;28.73,-12.79,;27.4,-13.56,;30.06,-13.56,;30.07,-15.1,;31.4,-12.78,;32.73,-13.55,;34.07,-12.77,;34.06,-11.23,;35.39,-10.45,;35.37,-8.91,;36.73,-11.2,;38.05,-10.42,;38.04,-8.88,;39.4,-11.17,;40.72,-10.39,;39.42,-12.73,;40.76,-13.48,;38.08,-13.51,;38.1,-15.05,;36.74,-12.75,;35.4,-13.53,;36.16,-14.86,;34.63,-14.86,;32.72,-10.47,;32.71,-8.93,;31.4,-11.24,)|
COc1c(Cl)c(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(C(=O)c4c(O)c(Cl)c(O)c(Cl)c4C3(C)C)c(O)c12 |(54.94,-6.7,;53.6,-7.47,;52.27,-6.71,;52.26,-5.17,;53.6,-4.39,;50.93,-4.4,;50.92,-2.86,;49.59,-5.18,;48.25,-4.42,;49.6,-6.72,;48.28,-7.5,;50.94,-7.47,;50.94,-9.88,;49.62,-10.65,;49.61,-12.2,;48.28,-12.97,;50.95,-12.97,;50.95,-14.51,;52.28,-12.19,;53.62,-12.96,;54.95,-12.18,;54.94,-10.63,;56.27,-9.85,;56.26,-8.31,;57.61,-10.61,;58.94,-9.83,;58.92,-8.29,;60.28,-10.58,;61.61,-9.8,;60.3,-12.14,;61.64,-12.89,;58.97,-12.92,;58.98,-14.46,;57.62,-12.16,;56.28,-12.94,;57.05,-14.27,;55.51,-14.27,;53.61,-9.87,;53.6,-8.34,;52.28,-10.65,)|
COc1cc(O)cc(C)c1-c1cc(O)cc2cc3c(C(=O)c4c(O)cc(O)cc4C3(C)C)c(O)c12 |(75.26,-6.27,;73.93,-7.05,;72.59,-6.28,;72.59,-4.74,;71.25,-3.97,;71.25,-2.43,;69.92,-4.75,;69.93,-6.29,;68.6,-7.07,;71.26,-7.05,;71.27,-9.46,;69.94,-10.23,;69.94,-11.77,;68.6,-12.54,;71.27,-12.54,;72.61,-11.76,;73.94,-12.53,;75.27,-11.75,;75.27,-10.21,;76.59,-9.43,;76.58,-7.89,;77.94,-10.18,;79.26,-9.4,;79.24,-7.86,;80.61,-10.16,;80.62,-11.71,;81.97,-12.46,;79.29,-12.49,;77.95,-11.73,;76.61,-12.51,;77.37,-13.84,;75.84,-13.84,;73.93,-9.45,;73.92,-7.91,;72.6,-10.22,)|
O=C(Nc1ccccc1)c1ccc(o1)-c1ccc(cc1)C(=O)Nc1ccccc1
Fc1ccc(NC(=O)c2ccc(o2)-c2ccc(cc2)C(=O)Nc2ccc(F)cc2)cc1
Clc1ccc(NC(=O)c2ccc(o2)-c2ccc(cc2)C(=O)Nc2ccc(Cl)cc2)cc1
O=C(Nc1ccccc1)c1ccc(s1)-c1ccc(cc1)C(=O)Nc1ccccc1
O=C(NC1CCCCC1)c1ccc(s1)-c1ccc(cc1)C(=O)NC1CCCCC1
O=C(Nc1ccccc1)c1ccc([nH]1)-c1ccc(cc1)C(=O)Nc1ccccc1
Fc1ccc(NC(=O)c2ccc([nH]2)-c2ccc(cc2)C(=O)Nc2ccc(F)cc2)cc1
O=C(Nc1ccccc1)c1cnc(s1)-c1ccc(cc1)C(=O)Nc1ccccc1
COc1ccccc1-c1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
CC(C)(C)OC(=O)CNC(=O)c1ccc2-c3ccccc3C(=O)C(=O)c2c1
O=C1C(=O)c2ccccc2-c2ccccc12
O=C1c2ccoc2-c2ccccc2C1=O
O=C1C(=O)c2cc(ccc2-c2ccccc12)-c1cc2ccccc2o1
Nc1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
CC(C)(C)C(=O)Nc1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
CCCC(=O)Nc1ccc2C(=O)C(=O)c3ccccc3-c2c1
Fc1ccccc1-c1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
Fc1ccccc1C(=O)Nc1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
O=C1C(=O)c2cccnc2-c2ccccc12
Fc1ccccc1C(=O)Nc1ccc2C(=O)C(=O)c3ccccc3-c2c1
O=C(COCc1ccccc1)Nc1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
CCOS(=O)(=O)\C=C\c1ccc(COc2cc(COc3ccc(C(O)=O)c(O)c3)ccc2C(=O)Nc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)cc1
N=c1oc2ccccc2cc1C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ncccn1
Cc1cc(C)n(-c2ccc(cc2)S(=O)(=O)Nc2ncccn2)c(=O)c1C#N
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccc(cc2)-c2ccccc2C#N)cc1)C(O)=O |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2nc3ccccc3[nH]2)cc1)C(O)=O |r|
Clc1ccc2sc(SCC(=O)Nc3cccc(c3)-c3nnn[nH]3)nc2c1
O=C1C(C(=S)N\C1=C/c1ccc(cc1)-c1ccccc1)c1ccccc1
COc1cc(CC2SC(=O)NC2=O)ccc1OS(=O)(=O)c1ccccc1
COc1cc(CC2SC(=O)NC2=O)ccc1OS(C)(=O)=O
OC(=O)c1ccc(\C=C\C(=O)c2cccc(c2)[N+]([O-])=O)cc1
OC(=O)C(=O)Nc1ccc(cc1)C#Cc1ccc(cc1)C(O)=O
c1ccc(cc1)[C@@H](C(=O)O)O
c1ccc(cc1)C(=O)C(=O)O
OC(=O)C(=O)c1ccc2ccccc2c1
OC(=O)C(F)(Oc1ccc2ccccc2c1)C(O)=O
c1ccc2cc(ccc2c1)CC(=O)O
COc1ccc(cc1)C(=O)C(O)=O
OC(=O)C(=O)c1ccc(cc1)[N+]([O-])=O
OC(C(O)=O)c1ccc2ccccc2c1
OC(=O)C(=O)c1cccs1
OC(C(O)=O)c1ccco1
OC(=O)C(=O)c1ccccc1C(O)=O
COc1ccc(cc1)C(O)C(O)=O
OC(=O)C(=O)c1c[nH]c2ccccc12
OC(=O)C(F)(F)c1ccc2ccccc2c1
OP(O)(=O)C(F)(F)c1ccccc1
O[C@@H](C(O)=O)c1ccccc1 |r|
COC(=O)c1ccc(cc1)C(=O)C(O)=O
OC(=O)C(=O)c1c(F)c(F)c(F)c(F)c1F
OC(=O)C(=O)c1ccco1
COc1ccc(cc1OC)C(=O)C(O)=O
[O-]C(=O)c1ccc2cc(ccc2c1)C([O-])=O
OC(=O)c1ccc2c(C(O)=O)c(O)ccc2c1
c1cc(cc2c1cc(cc2)C(F)(F)P(=O)(O)O)C(=O)O
CS(=O)(=O)Nc1cccc2cc(ccc12)S(O)(=O)=O
COc1ccc2cc(ccc2c1C(O)=O)C(O)=O
[O-]S(=O)(=O)c1ccc2cc(ccc2c1)S([O-])(=O)=O
OC(=O)COc1ccc2cc(ccc2c1C(O)=O)C(O)=O
CC(C)CC(NC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)C(CCC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C(C)NC(=O)C(CC(O)=O)NC(C)=O)C(N)=O
COC(=O)c1ccc2c(C(O)=O)c(OC)ccc2c1
[O-]S(=O)(=O)c1cccc2c(cccc12)S([O-])(=O)=O
OC(=O)COc1cc2ccc(cc2cc1C(O)=O)C(O)=O
NC(=O)[C@@H](CCC(O)=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc2cc(ccc2c1)C(O)=O
OC(=O)c1ccc2cc(OC(F)(F)C(O)=O)ccc2c1
NC(=O)[C@H](CCC(O)=O)NC(=O)c1ccc2c(C(O)=O)c(OCC(O)=O)ccc2c1
CC(C)CC(NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)C(CCC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C(C)NC(=O)C(CC(O)=O)NC(C)=O)C(N)=O
OC(=O)c1ccc2ccc(cc2c1)C(O)=O
OC(=O)c1ccc2c(cccc2c1)C(O)=O
c1cc2c(cc1S(=O)(=O)[O-])cc(cc2S(=O)(=O)[O-])S(=O)(=O)[O-]
[H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@H](O)C[C@@]4([H])C[C@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)NCCCNCCCCNCCCN)[C@H](C)CCC(OS(O)(=O)=O)C(C)C |r|
C[C@@H]1OCC2(CCN(CC2)c2nc(C)c(nc2CO)-c2cccc(Cl)c2Cl)[C@@H]1N |r|
CCc1c(c2ccc(cc2o1)S(=O)(=O)Nc3ccc(cc3)S(=O)(=O)Nc4nccs4)C(=O)c5cc(c(c(c5)Br)O)Br
CC[C@@H](C)C[C@@H](C)\C=C(/C)\C=C\C=C\C=C(/C)C(=O)c1c(O)c(cn(O)c1=O)-c1ccc(O)cc1 |r|
Cc1ccc(cc1)N1N=C(\C(=N\Nc2ccc(cc2)S(O)(=O)=O)C1=O)c1ccc(cc1)[N+]([O-])=O |c:9|
COc1ccc(cc1)N1N=C(\C(=N\Nc2ccc(cc2)S(O)(=O)=O)C1=O)c1ccc(cc1)[N+]([O-])=O |c:10|
OS(=O)(=O)c1ccc(N\N=C2/C(=O)N(N=C2c2ccc(cc2)[N+]([O-])=O)c2ccc(cc2)C(F)(F)F)cc1 |c:14|
OS(=O)(=O)c1ccc(N\N=C2/C(=O)N(N=C2c2ccc(cc2)[N+]([O-])=O)c2ccc(Cl)cc2)cc1 |c:14|
OS(=O)(=O)c1ccc(N\N=C2/C(=O)N(N=C2c2ccc(cc2)[N+]([O-])=O)c2ccc(cc2)[N+]([O-])=O)cc1 |c:14|
OS(=O)(=O)c1ccc(cc1)N=Nc1c([nH]n(-c2ccccc2)c1=O)-c1ccc(cc1)[N+]([O-])=O |w:10.10|
CCOC(=O)c1ccc(cc1)N1N=C(\C(=N\Nc2ccc(cc2)S(O)(=O)=O)C1=O)c1ccc(cc1)[N+]([O-])=O |c:13|
Cc1cccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c1C
c1ccc2c(c1)ccc(n2)C(=O)O
OC(=O)c1cc(on1)-c1ccc(Br)cc1
c1cc(c(cc1N)O)C(=O)O
ClC1=C(Cl)C(=O)c2cnncc2C1=O |c:1|
Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cnccc12 |w:6.6|
COC1C(=N)C(=O)c2nc(ccc2C1=O)-c1nc(C(=O)OC)c(C)c(c1N)-c1ccc(OC)c(OC)c1O |(10.32,-.31,;10.33,-1.86,;11.68,-2.63,;11.68,-4.17,;10.33,-4.94,;13,-4.93,;13.01,-6.48,;14.33,-4.16,;15.67,-4.93,;17,-4.16,;16.98,-2.62,;15.65,-1.86,;14.33,-2.63,;13,-1.85,;13,-.29,;18.33,-4.93,;19.66,-4.15,;21,-4.92,;22.33,-4.15,;22.31,-2.6,;23.67,-4.91,;25,-4.12,;21,-6.46,;22.34,-7.23,;19.66,-7.25,;18.33,-6.48,;17,-7.25,;19.67,-8.79,;18.33,-9.55,;18.33,-11.09,;19.66,-11.86,;19.67,-13.41,;18.33,-14.18,;21,-11.09,;22.34,-11.85,;22.35,-13.4,;21,-9.55,;22.33,-8.78,)|
ClC1=C(Cl)C(=O)c2ncccc2C1=O |c:1|
Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2ncccc12 |w:6.6|
O=C1C=CC(=O)c2ncccc12 |c:2|
Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cnncc12 |w:6.6|
CC(Nc1cc(O)c2ncccc2c1O)C(=O)c1ccccc1
COc1cc(CC=Nc2cc(O)c3cccnc3c2O)ccc1O |w:6.5|
CCCCCCOc1ccc(NC2=C(Cl)C(=O)c3cccnc3C2=O)cc1 |c:12|
OCCOCCN1CCN(CC1)C1=C(Cl)C(=O)c2cccnc2C1=O |c:13|
ClC1=C(Cl)C(=O)c2ncncc2C1=O |c:1|
Oc1c(Cl)c(N=CCc2c[nH]c3ccccc23)c(O)c2ncccc12 |w:6.6|
ClC1=C(Cl)C(=O)c2cnccc2C1=O |c:1|
CC(Nc1cc(O)c2cccnc2c1O)C(=O)c1ccccc1
Oc1cc(N=CCc2cc(Br)c(O)c(Br)c2)c(O)c2ncccc12 |w:5.5|
Oc1c(Cl)c(N=CCN2CCOCC2)c(O)c2cccnc12 |w:6.6|
OC(=O)C(Cc1c[nH]c2ccccc12)=Nc1c(O)c2ncccc2c(O)c1Cl |w:14.16|
CCCCCNC(=O)C(Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)CCC(O)=O
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)-c1nnn[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
CCN(CC)C(=O)CCC1=C(c2ccccc2)c2ccccc2C(=O)C1=O |c:9|
NC1=CC(=O)C(=O)c2ccccc12 |t:1|
COC1=CC(=O)C(=O)c2ccccc12 |t:2|
CCOC(=O)CCC1=C(c2ccccc2C(=O)C1=O)n1ccc2ccccc12 |t:7|
COc1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12 |t:9|
[O-][N+](=O)c1ccccc1C1=CC(=O)C(=O)c2ccccc12 |t:10|
OC(=O)COc1ccc(CC2=C(c3ccccc3C(=O)C2=O)n2ccc3ccccc23)cc1 |t:10|
CCOC(=O)COc1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12 |t:14|
CN(C1=CC(=O)C(=O)c2ccccc12)c1ccccc1 |t:2|
[O-][V](=O)=O
COC(=O)c1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12 |t:11|
CCOC(=O)CCC1=C(c2ccccc2)c2ccccc2C(=O)C1=O |c:7|
OC(=O)c1ccc2[nH]cc(C3=CC(=O)C(=O)c4ccccc34)c2c1 |t:10|
CC(C)(C)OC(=O)COc1ccc(CC2=C(c3ccccc3)c3ccccc3C(=O)C2=O)cc1 |c:14|
O=C1C=C(C2CCCC2)c2ccccc2C1=O |t:2|
O=C1C=C(c2ccccc2)c2ccccc2C1=O |t:2|
CC(C)(C)OC(=O)COc1ccc(CC2=C(c3ccccc3C(=O)C2=O)n2ccc3ccccc23)cc1 |t:14|
O=C1C=C(c2c[nH]c3ccccc23)c2ccccc2C1=O |t:2|
Oc1ccccc1C1=CC(=O)C(=O)c2ccccc12 |t:8|
CCOC(=O)Nc1cccc2C(=CC(=O)C(=O)c12)c1ccccc1 |c:11|
Clc1ccc(Cl)c(c1)C1=CC(=O)C(=O)c2ccccc12 |t:9|
CCCCCOC1=C(c2ccccc2)c2ccccc2C(=O)C1=O |c:6|
O=C1C=C(C2CCCCC2)c2ccccc2C1=O |t:2|
COc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1 |c:6|
O=C1C=Cc2ccccc2C1=O |c:2|
O=C(Nc1cccc2C(=CC(=O)C(=O)c12)c1ccccc1)OCc1ccccc1 |c:8|
[O-]S(=O)(=O)C1=CC(=O)C(=O)c2ccccc12 |t:4|
OC(=O)c1ccc2c(c[nH]c2c1)C1=CC(=O)C(=O)c2ccccc12 |t:14|
CCOC(=O)COc1ccccc1C1=CC(=O)C(=O)c2ccccc12 |t:14|
O=C1C=C(c2ccc(cc2)-c2ccccc2)c2ccccc2C1=O |t:2|
OC(=O)COc1ccc(CC2=C(c3ccccc3)c3ccccc3C(=O)C2=O)cc1 |c:10|
COC(=O)CCC1=C(c2ccccc2)c2cc(CCC(=O)OC)ccc2C(=O)C1=O |c:6|
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C1=CC(=O)C(=O)c2ccccc12 |t:16|
O=C1C=C(c2ccccc2C1=O)c1cccc2ccccc12 |c:2|
CC(C)C1=CC(=O)C(=O)c2ccccc12 |t:3|
OCCCOC1=CC(=O)C(=O)c2ccccc12 |t:5|
COC(=O)CCC1=C(c2ccc(CCC(=O)OC)cc2C(=O)C1=O)n1ccc2ccccc12 |t:6|
O=C(Nc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1)OCc1ccccc1 |c:7|
CCCCCCC1=CC(=O)C(=O)c2ccccc12 |t:6|
COC(=O)CCc1ccc2C(=O)C(=O)C=C(c3ccccc3)c2c1 |t:14|
COC(=O)CCc1ccc2C(=O)C(=O)C=C(c2c1)n1ccc2ccccc12 |c:14|
COC(=O)C(Cc1ccccc1)Oc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1 |c:18|
OC(=O)C(Cc1ccccc1)Oc1ccc2C(=CC(=O)C(=O)c2c1)n1ccc2ccccc12 |c:17|
CCCCCOc1ccc2C(=CC(=O)C(=O)c2c1)c1ccccc1 |c:10|
Oc1ccc(cc1)C1=CC(=O)C(=O)c2ccccc12 |t:8|
Fc1ccc(F)c(c1)C1=CC(=O)C(=O)c2ccccc12 |t:9|
O=C1C=C(Cc2ccccc2)c2ccccc2C1=O |t:2|
CCOC(=O)c1ccc(CCC2=C(c3ccccc3)c3ccccc3C(=O)C2=O)cc1 |c:11|
COc1ccc(cc1)-n1cc(-c2ccc3ccc(=O)oc3c2)c2cc(cnc12)-c1ccc(cc1)C(O)=O
OC(=O)C(=O)c1ccc(O)cc1
OC(=O)C(=O)c1ccc(OCc2cccc(COc3ccc(cc3)C(=O)C(O)=O)c2)cc1
OC(=O)C(=O)c1ccc(OCc2ccccc2COc2ccc(cc2)C(=O)C(O)=O)cc1
OC(=O)C(=O)c1ccc(OCc2cc(COc3ccc(cc3)C(=O)C(O)=O)cc(COc3ccc(cc3)C(=O)C(O)=O)c2)cc1
OC(=O)C(=O)Nc1sc2CN(Cc3ccccn3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3ccc(cc3)-c3ccccc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCC(c3ccccc3)c3ccccc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(Cc3ccncc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(Cc3ccc4ccccc4n3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3ccccc3OCc3ccccc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(Cc3ccc4ccccc4c3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3ccncc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3ccsc3)CCc2c1C(O)=O
COc1cccc(CN2CCc3c(C2)sc(NC(=O)C(O)=O)c3C(O)=O)c1
OC(=O)C(=O)Nc1sc2CN(Cc3ccccc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCCc3ccccc3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3ccccn3)CCc2c1C(O)=O
OC(=O)C(=O)Nc1sc2CN(CCc3cccc4ccccc34)CCc2c1C(O)=O
CN1CCc2c(C1)sc(NC(=O)C(O)=O)c2C(O)=O
OC(=O)C(=O)Nc1sc2CN(Cc3cccnc3)CCc2c1C(O)=O
C1CNCc2c1c(c(s2)NC(=O)C(=O)O)C(=O)O
OC(=O)C(=O)Nc1sc2CC(CCc2c1C(O)=O)C1OCCO1
OC(=O)C(=O)Nc1sc2CN(CCc3ccc(OCc4ccccc4)cc3)CCc2c1C(O)=O
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O |r|
CC[C@H](C)[C@H](N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H]([C@@H](C)CC)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCSC)NC(=O)[C@@H](N)[C@@H](C)O)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCSC)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCCN1)[C@@H](C)CC)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O |r|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)COCCOCCNC(=O)C(C1CC1)n1cc(nn1)-c1cccc(OC)c1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)COCCOCCNC(=O)C(C1CC1)n1cc(nn1)-c1cccc(OC)c1)C(N)=O |t:6|
NC(=O)C(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)NC(=O)C(CNC(=O)CCCCCNC1=NS(=O)(=O)c2ccccc12)NC(=O)Cc1ccc(CNC(=O)[C@H](C2CC2)n2cc(CC3CCCCC3)nn2)cc1 |r,t:40|
NC(=O)C(CNC(=O)CCCCCNC1=NS(=O)(=O)c2ccccc12)NC(=O)Cc1ccc(CNC(=O)[C@H](C2CC2)n2cc(CC3CCCCC3)nn2)cc1 |r,t:14|
CCC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)C1CCCC(C1)NC(=O)C(C1CC1)n1cc(CC2CCCCC2)nn1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)C1CCCC(C1)NC(=O)C(C1CC1)n1cc(CC2CCCCC2)nn1)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)CC1(CCCCC1)NC(=O)C(C1CC1)n1cc(CC2CCCCC2)nn1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)CC1(CCCCC1)NC(=O)C(C1CC1)n1cc(CC2CCCCC2)nn1)C(N)=O |t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)C1(CC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)C1(CC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)C1CCCC(C1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)C1CCCC(C1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(N)=O |r,t:6|
CC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)CC1(CCCCC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:5|
CC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)CC1(CCCCC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(N)=O |r,t:5|
CCC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)CC1(CCCCC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NC[C@@H](NC(=O)CC1(CCCCC1)NC(=O)[C@H](CC(C)(C)C)n1cc(CC2CCCCC2)nn1)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)c1ccccc1NC(=O)c1n[nH]c2ccc(cc12)[N+]([O-])=O)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:6|
CCCCC(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)c1ccccc1NC(=O)c1n[nH]c2ccc(cc12)[N+]([O-])=O)C(N)=O |t:6|
CC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)c1n[nH]c2ccc(cc12)[N+]([O-])=O)C(=O)NC(CCCCNC(=O)CCCC[C@@H]1SCC2NC(=O)NC12)C(N)=O |r,t:5|
CC(C)C(NC1=NS(=O)(=O)c2ccccc12)C(=O)NCC(NC(=O)c1n[nH]c2ccc(cc12)[N+]([O-])=O)C(N)=O |t:5|
OC(=O)CCC(NC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)COc1ccc(cc1)C(=O)CBr)C(O)=O
Fc1ccc(cc1)C(=O)CCl
Fc1ccc(cc1)C(=O)CBr
OC(=O)CCC(NC(=O)[C@H](CCC(O)=O)NC(=O)CNC(=O)c1ccccc1-c1ccc(cc1)C(=O)CBr)C(O)=O
BrCC(=O)c1ccc2ccccc2c1
OC(=O)COc1ccc(cc1)C(=O)CCl
BrCC(=O)c1cccc2ccccc12
FC(F)(F)c1ccc(cc1)C(=O)CBr
Oc1ccc(cc1)C(=O)CBr
Oc1ccc(cc1O)C(=O)CCl
c1ccc(cc1)C(=O)CBr
BrCC(=O)c1ccccn1
Fc1ccc(C(=O)CCl)c(F)c1
[O-][N+](=O)c1ccc(cc1)C(=O)CBr
COc1ccc(cc1)C(=O)CBr
c1cc(ccc1C(=O)CBr)OCC(=O)O
C(C(=O)O)Br
[#7]\[#6](-[#7])=[#7]\[#6]-[#6]-[#6]-[#6](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#8]-c1ccc(cc1)-[#6](=O)-[#6]Br)-[#6](-[#8])=O
BrCC(=O)c1ccc(cc1)-c1ccccc1
OC(=O)c1ccccc1-c1ccc(cc1)C(=O)CBr
ClCC(=O)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1nc2ccc(cc2s1)[N+]([O-])=O)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1nc2ccccc2s1)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1cnc2ccccc2c1)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1ccc(cc1)N1CCOCC1)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1ccc(cc1)-n1ccnc1)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1ccc2nc([nH]c2c1)C(F)(F)F)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1ccc(OCc2ccccc2)c(Cl)c1)c1ccccc1
Cc1c(Br)cc(NC(=O)C(c2ccccc2)S(O)(=O)=O)cc1Br
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1oc2cc(-[#8])cc(-[#8])c2c(=O)c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])c(-[#8])c2)c(-[#8])cc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1oc2c(c(-[#8])cc(-[#8])c2c(=O)c1-[#8])C([#6])([#6])[#6]=[#6]
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc(cc(-[#8])c1-[#8])-[#6]-1-[#6]-[#6]-c2ccc(-[#8])cc2-[#8]-1
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(OC)cc1
CCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Oc1ccccc1
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1nn[nH]c1=S
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CCc1ccccc1
CCCCCNC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](C)NC(=O)OC(C)(C)C
CCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(cc1)C(F)(F)F
[#6]-c1cc(ccc1-c1ccc(\[#6]=[#6]-2\[#6](=O)-c3ccccc3-[#6]-2=O)o1)-[#6](-[#8])=O
OC(=O)c1cccc2C3C(Cl)C(CC3C(Nc12)c1ccc(F)cc1)Sc1ccccc1[N+]([O-])=O
OC(=O)c1cc(ccc1O)-c1ccc(\C=C2/Sc3ccccc3C2=O)o1
OC(=O)c1cccc2C3C(Cl)C(CC3C(Nc12)c1cccc(Br)c1)Sc1ccccc1[N+]([O-])=O
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)OC |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O)OC=C2C(=O)OC |r,c:13,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccccc1 |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccccc1F |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccccc1CC |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccccc1OC |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccc(Oc2ccccc2)cc1 |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccc(cc1)-c1ccccc1 |r,c:26,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)OC=C2C(=O)Nc1ccc(Oc2ccc(cc2)C(C)(C)C)cc1 |r,c:26,t:3|
[H][C@]12CC=C(COCc3ccccc3)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]1OCc1ccccc1)OC=C2C(=O)OC |r,c:66,t:3|
[H][C@]12CC=C(COCc3ccccc3)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]1OCc1ccccc1)OC=C2C(O)=O |r,c:66,t:3|
[H][C@]12CC=C(COCc3ccccc3)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]1OCc1ccccc1)OC=C2C(=O)NCc1ccc(\C=C\S(=O)(=O)OCC)cc1 |r,c:66,t:3|
[H][C@]12CC=C(COCc3ccccc3)[C@@]1([H])[C@H](O[C@]1([H])O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]1OCc1ccccc1)OC=C2C(=O)Nc1ccc(Oc2ccccc2)cc1 |r,c:66,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](OC)OC=C2C(=O)OC |r,c:14,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](OCc1ccccc1)OC=C2C(=O)OC |r,c:21,t:3|
[H][C@]12CC=C(CO)[C@@]1([H])[C@H](OCC)OC=C2C(=O)OC |r,c:15,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OCc1ccccc1)OC=C2C(=O)OC |r,c:36,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OC)OC=C2C(=O)Nc1ccc(Oc2ccccc2)cc1 |r,c:29,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OC)OC=C2C(=O)Nc1ccc(Oc2ccc(cc2)-c2ccccc2)cc1 |r,c:29,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OC)OC=C2C(=O)Nc1ccc(Oc2ccc(Br)cc2Cl)cc1 |r,c:29,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OC)OC=C2C(=O)Nc1ccc(Oc2ccc3ccccc3c2)cc1 |r,c:29,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OCc1ccccc1)OC=C2C(=O)Nc1ccc(Oc2ccccc2)cc1 |r,c:36,t:3|
[H][C@]12CC=C(COc3ccc(\C=C\S(=O)(=O)OCC)cc3)[C@@]1([H])[C@H](OCc1ccccc1)OC=C2C(=O)Nc1ccc(Oc2ccc(Br)cc2Cl)cc1 |r,c:36,t:3|
[H][C@@]1(COC(=O)C1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
OC(=O)c1cc2ccccc2oc1=O
Nc1oc2ccccc2c(=O)c1C=O
Clc1ccc2occ(C=O)c(=O)c2c1
Clc1cc(Cl)c2occ(C=O)c(=O)c2c1
[O-][N+](=O)c1ccc2occ(C=O)c(=O)c2c1
Fc1ccc2occ(C=O)c(=O)c2c1
O=Cc1coc2ccc(cc2c1=O)-c1ccccc1
Brc1cc(Br)c2occ(C=O)c(=O)c2c1
Brc1ccc2occ(C=O)c(=O)c2c1
O=Cc1coc2c3ccccc3ccc2c1=O
O=Cc1coc2ccccc2c1=O
Cc1cc2occ(C=O)c(=O)c2cc1Cl
O=Cc1coc2ccc(cc2c1=O)-c1ccc(cc1)-c1ccccc1
OC(=O)c1coc2ccccc2c1=O
c1ccc2c(c1)C(=O)C=C(O2)C(=O)O
O=Cc1coc2ccc3ccccc3c2c1=O
CC(C)c1ccc2occ(C=O)c(=O)c2c1
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)c(OCC(O)=O)c1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OC(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCc1ccccc1)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(C(O)=O)C(O)=O)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OC(F)(C(O)=O)C(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(CC(O)=O)c(O)c1)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(C(O)=O)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCCc1ccccc1)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(C(O)=O)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2ccc(Br)c(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)NC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cc(Cl)cc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2ccc(c(O)c2C(=O)OC)-c2ccccc2)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
Nc1c(Br)c(O)c(cc1C#N)C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2ccccc2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
Cc1cc(C)c2nc(ccc2c1O)C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCOc2cccc(O)c2[N+]([O-])=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CS(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
C[C@H]1CCC[C@@H](C)N1NC(=O)c1ccc(Cl)c(c1)S(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
OC1(NC(=O)c2ccccc12)c1ccc(Cl)c(c1)S(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1ccc2cc(ccc2c1)C(=O)NS(=O)(=O)c1ccccc1
CCN1CCCC1CNC(=O)c1cc(ccc1OC)S(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
CCCCCCCCCCCCCCCCOc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
CC1Cc2ccccc2N1NC(=O)c1ccc(Cl)c(c1)S(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1ccc2cc(ccc2c1)C(=O)NS(=O)(=O)Cc1ccccc1
CCCCCCCCCC(=O)Nc1ccc(cc1)S(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(cc1)N(CC(C(O)=O)c1ccccc1)C(=O)C(O)=O)NC(=O)OC(C)(C)C
COC(=O)c1c(O)cccc1OCCCCNC(=O)C(Cc1ccc(OC(C(N)=O)C(O)=O)cc1)NC(=O)OC(C)(C)C
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(cc1)N(CCC(O)=O)C(=O)C(O)=O)NC(=O)OC(C)(C)C
CCC(CC(O)=O)N(C(=O)C(O)=O)c1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)cc1
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(cc1)OC(C(=O)O)C(=O)O)C(=O)NCCCCOc2cccc(c2C(=O)OC)O
COC(=O)c1c(O)cccc1OCCCCNC(=O)C(Cc1ccc(OC(C(O)=O)C(=O)NC2CC2)cc1)NC(=O)OC(C)(C)C
Cc1nc2ccccc2n2cccc12
Cc1ccc2c(c1)nc(C)c1cccn21
Cc1nc2cc(ccc2n2cccc12)C(F)(F)F
COc1ccc2c(c1)nc(C)c1cccn21
Cc1nc2ccc(Cl)cc2n2cccc12
Cc1cc2nc(C)c3cccn3c2cc1C
Cc1nc2cc(Cl)c(Cl)cc2n2cccc12
Cc1[n+](C)c2ccccc2n2cccc12
Cc1ccc2c(c1)[n+](C)c(C)c1cccn21
Cc1cccc(Cc2[n+](C)c3cc(ccc3n3cccc23)C(F)(F)F)c1
COc1ccc2c(c1)[n+](C)c(C)c1cccn21
Cc1[n+](C)c2ccc(Cl)cc2n2cccc12
CCCC[n+]1c(C)c2cccn2c2ccccc12
CC1Nc2ccccc2-n2cccc12
COc1ccc-2c(NC(C)c3cccn-23)c1
CC1Nc2ccc(Cl)cc2-n2cccc12
CC1Nc2cc(Cl)c(Cl)cc2-n2cccc12
CC1N(C)c2ccccc2-n2cccc12
CCCCCCS(=O)(=O)NC(=O)c1ccc(CSCc2ccc(cc2)-c2ccccc2)cc1
CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C(=O)O
[H][C@@]1(CC[C@]2([H])[C@@]3([H])CC=C4[C@@]([H])(CC[C@]5(CCC(C)(C)C[C@@]45[H])C(O)=O)[C@]3([H])CC[C@@]2([H])C1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r,c:9|
C(c1ccccc1)c1nc2ccccc2n2cccc12
CCCC(=O)Nc1cccc(c1)-c1cc(no1)C(O)=O
Nc1nc(N)c2nc(CN3CCNCC3)nnc2n1
CCN(CC)Cc1nnc2nc(N)nc(N)c2n1
Nc1nc(N)c2nc(CN3CCN(Cc4ccc5ccccc5c4)CC3)nnc2n1
Nc1nc(N)c2nc(CN3CCN(Cc4cccc5ccccc45)CC3)nnc2n1
Nc1nc(N)c2nc(CN3CCOCC3)nnc2n1
Nc1nc(N)c2nc(CN(CCO)CCO)nnc2n1
CN1CCN(Cc2nnc3nc(N)nc(N)c3n2)CC1
Nc1nc(N)c2nc(CN3CCN(Cc4ccccc4)CC3)nnc2n1
Nc1nc(N)c2nc(CN3CCN(CC3)c3ccccc3)nnc2n1
Nc1nc(N)c2nc(CN3CCN(Cc4ccc(cc4)-c4ccccc4)CC3)nnc2n1
Nc1nc(N)c2nc(CN3CCCCC3)nnc2n1
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)-[#8]-c2cc(\[#6]=[#6]\c3ccc(-[#8])cc3-[#8])cc(-[#8])c2-c2cc(-[#6])cc(c2)-c2ccc(-[#8])cc2-[#8])c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)-[#8]-c2cc(cc(-[#8])c2-c2cc(-[#6])cc(c2)-c2ccc(-[#8])cc2-[#8])-c2cc3ccc(-[#8])cc3o2)c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(c(-[#8])cc1-[#8])-c1oc2cc(-[#8])cc(-[#8])c2c(=O)c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(c(-[#8])cc1-[#8])-c1oc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc(-[#8])c2c(=O)c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])c2c1oc(-c1ccc(-[#8])cc1-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2=O
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(oc2cc3-[#8]C([#6])([#6])[#6]=[#6]-c3c(-[#8])c2c1=O)-c1ccc(-[#8])cc1-[#8] |c:15|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(cc1-[#8])-c1cc2ccc(-[#8])cc2o1
Cc1cc2O[C@](C)(CC[C@@H](O)C(=C)C\C=C\C(C)(C)O)C=Cc2c(O)c1C(O)=O |r,c:20|
CC(=C)[C@H](O)CCC(=C)[C@H](O)CC[C@@]1(C)Oc2cc(C)c(C(O)=O)c(O)c2C=C1 |r,c:28|
CC(=C)\C=C\C\C(C)=C\CC[C@@]1(C)Oc2cc(C)c(C(O)=O)c(O)c2C=C1 |r,c:26|
CC(=C)[C@H](O)CC\C(C)=C\CC[C@@]1(C)Oc2cc(C)c(C(O)=O)c(O)c2C=C1 |r,c:27|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6](=[#6])-[#6@H](-[#8])-[#6]-[#6][C@@]1([#6])[#8]-c2cc(-[#6])c(-[#6](-[#8])=O)c(-[#8])c2-[#6]=[#6]1 |r,c:27|
[#6]-[#8][C@@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6@H](-[#8])-[#6]-[#6][C@@]1([#6])[#8]-c2cc(-[#6])c(-[#6](-[#8])=O)c(-[#8])c2-[#6]=[#6]1 |r,c:29|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#6])c(-[#6](-[#8])=O)c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]1([#6])[#8]-c2cc(-[#6])c(-[#6](-[#8])=O)c(-[#8])c2-[#6]=[#6]1 |r,c:26|
C\C(C\C=C/C(C)(C)O)=C/CC[C@@]1(C)Oc2cc(C)c(C(O)=O)c(O)c2C=C1 |r,c:27|
OC(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)OCc2ccccc2)C(=O)OCc2ccccc2)cc1
CC(=O)NS(=O)(=O)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)OCc2ccccc2)C(=O)OCc2ccccc2)cc1
CS(=O)(=O)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)OCc2ccccc2)C(=O)OCc2ccccc2)cc1
CC(C)OC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)OC(C)C
OP(O)(=O)C(F)(F)c1ccc(CC(C\C=C\c2ccccc2)(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)c2ccccc2)cc1
COC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(O)=O
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)c2ccccc2)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)OCc2ccccc2)C(=O)OCc2ccccc2)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(OCc2ccccc2)OCc2ccccc2)cc1
COC(=O)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)OCc1ccccc1
OP(O)(=O)C(F)(F)c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1Cl
OP(O)(=O)C(F)(F)c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1-c1ccccc1
Cc1ccc2cc(cc(c2n1)P(O)(O)=O)-c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(C\C=C\c2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(CCCc2ccccc2)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(Br)cc2)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2nc(cs2)-c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(OCc3ccccc3)cc2)(c2ccccc2)n2nnc3ccccc23)cc1
c1ccc(cc1)C(Cc2ccc(cc2)C(F)(F)P(=O)(O)O)(Cc3ccc(cc3)C(F)(F)P(=O)(O)O)n4c5ccccc5nn4
OP(O)(=O)C(F)(F)c1ccc(CC(C\C=C\c2ccccc2)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)c1cccc(c1)-c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(c(Br)c2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1
c1ccc2c(c1)nnn2C(Cc3ccc(cc3)C(F)(F)P(=O)(O)O)(Cc4ccc(cc4)C(F)(F)P(=O)(O)O)c5ccc(c(c5)F)F
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccc3ccccc3n2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2nc3ccccc3s2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)-c2ccccc2)(c2ccccc2)n2nnc3ccccc23)cc1
NS(=O)(=O)c1ccccc1-c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(cc1)C(C(c1ccccc1)n1nnc2ccccc12)c1ccc(cc1)-c1ccccc1-c1nnn[nH]1
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(c2nnn[nH]2)n2nnc3ccccc23)cc1
COC(=O)c1ccc(cc1)C(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)n1nnc2ccccc12
OP(O)(=O)C(F)(F)c1ccc(CC(C(=O)OCc2ccccc2)(c2ccccc2)n2nnc3ccccc23)cc1
OP(O)(=O)C(F)(F)c1ccc(CC(c2ccccc2)n2nnc3ccccc23)cc1
OC(=O)c1ccccc1NC(=O)CSc1nc2cc(Oc3cccc4ccccc34)ccc2[nH]1
OC(=O)c1ccc(NC(=O)CSc2nc3cc(Oc4ccc5ccccc5c4)ccc3[nH]2)cc1
OC(=O)c1ccc(NC(=O)CSc2nc3cc(Oc4cccc5ccccc45)ccc3[nH]2)cc1
OC(=O)c1ccc(NC(=O)CSc2nc3cc(Oc4ccc5ccccc5c4)c(Cl)cc3[nH]2)cc1
Oc1cc2ccc(cc2c(F)c1N1CC(=O)NS1(=O)=O)C1CCN(C1)S(=O)(=O)C1CC1
CC(C)(CCOc1ccc2cc(O)c(N3CC(=O)NS3(=O)=O)c(F)c2c1)C#N
Oc1cc2ccc(cc2c(F)c1N1CC(=O)NS1(=O)=O)-c1cnn(CC2CC2)c1
C[C@H](O)CCOc1ccc2cc(O)c(N3CC(=O)NS3(=O)=O)c(F)c2c1 |r|
Oc1cc2ccc(NCCN3CCC3)cc2c(F)c1N1CC(=O)NS1(=O)=O
Oc1cc2ccc(OCCC3CC3(F)F)cc2c(F)c1N1CC(=O)NS1(=O)=O
Oc1cc2ccc(NCCC3CC3)cc2c(F)c1N1CC(=O)NS1(=O)=O
Oc1cc2ccc(OCC3CCCOC3)cc2c(F)c1N1CC(=O)NS1(=O)=O
CCS(=O)(=O)N1CC=C(C1)c1ccc2cc(O)c(N3CC(=O)NS3(=O)=O)c(F)c2c1 |c:7|
CC(C)CCS(=O)(=O)N1CC=C(C1)c1ccc2cc(O)c(N3CC(=O)NS3(=O)=O)c(F)c2c1 |c:10|
CC(C)(O)CCOc1ccc2c(F)c(N3CC(=O)NS3(=O)=O)c(O)cc2c1
CC(C)(CCOc1cc2c(F)c(N3CC(=O)NS3(=O)=O)c(O)cc2cc1O)C#N
CCCCC\C=C/C\C=C/CCCCCCCC1(O)CC(=O)c2c(O)cc(O)cc2O1
CC\C=C/C\C=C/C\C=C/CCCCCCCC1(O)CC(=O)c2c(O)cc(O)cc2O1
CCCC\C=C\CCCCCCCCCC1(O)CC(=O)C2=C(O)C(C)C(O)C(C)=C2O1 |c:20,28|
OC(=O)C(=O)Nc1sc2C(CNC(=O)c3cc4cc(F)ccc4[nH]3)NCCc2c1C(O)=O
C\C=C(\COC(C)=O)C(=O)O[C@@H]1C\C(C)=C\C[C@H](O)\C(C)=C\[C@H]2OC(=O)C(=C)[C@H]12 |r,t:14,20|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(C)=C\CC\C(C)=C\2)OC(=O)C(\CO)=C/COC(C)=O |r,t:13,18|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(CO)=C\CC\C(C)=C\2)OC(=O)C(\C)=C\C |r,t:14,19|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(C)=C\CC\C(C)=C\2)OC(=O)C(\CO)=C/C |r,t:13,18|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(C)=C\[C@@H](O)C\C(C)=C\2)OC(=O)C(\CO)=C/C |r,t:13,19|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(C)=C\[C@@H](O)C\C(C)=C\2)OC(=O)C(\COC(C)=O)=C/C |r,t:13,19|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(CC(O)=O)=C\CC\C(C)=C\2)OC(=O)C(\C)=C\C |r,t:16,21|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(C)=C\CC\C(C)=C\2)OC(=O)C(\CO)=C\C |r,t:13,18|
C\C=C(/COC(C)=O)C(=O)O[C@@H]1C\C(C)=C\CC\C(C)=C\[C@H]2OC(=O)C(=C)[C@H]12 |r,t:14,19|
[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\C(C)=C\CC\C(C)=C\2)OC(=O)C(\CO)=C\CO |r,t:13,18|
OC(=O)c1cccc(\C=C\c2ccc(Oc3cnoc3-c3ccccc3Cl)cc2)c1
OC(=O)c1cccc(\C=C\c2ccc(Oc3cnoc3-c3cccc(Cl)c3)cc2)c1
OC(=O)c1cccc(\C=C\c2ccc(Oc3cnoc3-c3cccc(c3)[N+]([O-])=O)cc2)c1
OC(=O)c1cccc(\C=C\c2ccc(Oc3cnoc3-c3ccc(Cl)c(Cl)c3)cc2)c1
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r|
[H][C@]12C[C@]3(OCNc4ccccc34)C(=O)[C@]1(C)[C@@]1(C)CCC3O[C@@H](C(=O)C=C3[C@]1(O)CC2)C(C)(C)O |r,c:29|
[H][C@]12Cc3c([nH]c4ccccc34)[C@]1(C)[C@@]1(C)CCC(=O)c3c4OC(C)(C)[C@H](O)c4nc(C2)c13 |r|
[H][C@@]12C[C@H](O)[C@]3(C)Oc4c(Cl)c(O)c5C(=O)O[C@H](C)Cc5c4C[C@@]3([H])[C@@]1(C)CC(Cl)(Cl)C(=O)C2(C)C |r|
[H][C@@]12C[C@H](O)[C@]3(C)Oc4cc(O)c5C(=O)O[C@H](C)[C@H](OC(C)=O)c5c4C[C@@]3([H])[C@@]1(C)C=C[C@H](O)C2(C)C |r,c:34|
[H][C@@]12C[C@H](O)[C@]3(C)Oc4cc(O)c5C(=O)O[C@H](C)[C@H](OC)c5c4C[C@@]3([H])[C@@]1(C)C=CC(=O)C2(C)C |r,c:32|
Cc1ccccc1N1CC(=O)NS1(=O)=O
O=C1CN(c2cccc(c2)-c2ccccc2)S(=O)(=O)N1
COc1ccccc1N1CC(=O)NS1(=O)=O
c1ccc(cc1)N2CC(=O)NS2(=O)=O
COc1ccc(cc1N1CC(=O)NS1(=O)=O)-c1ccccc1
[H][C@]12O[C@@]1(C)[C@]1([H])[C@]3([H])[C@H](Oc4ccc(C[C@]5(O)C[C@]6(C[C@H](O)OO[C@]2(C)[C@]3([H])C6=O)C(=O)N5)cc4)[C@]2([H])[C@@H](C)C[C@@H](C)C[C@@]12C |r|
[H][C@]12O[C@@]1(C)[C@]1([H])[C@]3([H])[C@H](Oc4ccc(C[C@@]5(C[C@]6(C[C@H](O)OO[C@]2(C)[C@]3([H])C6=O)C(=O)N5)OC)cc4)[C@]2([H])[C@@H](C)C[C@@H](C)C[C@@]12C |r|
[H][C@@]12[C@H](Oc3ccc(C[C@]4(O)C[C@]5(C[C@@H](O)[C@](C)(C=O)[C@]1([H])C5=O)C(=O)N4)cc3)[C@]1([H])[C@@H](C)C[C@@H](C)C[C@@]1(C)[C@@H]2C(C)=O |r|
[H][C@@]12[C@H](Oc3ccc(C[C@@]4(C[C@]5(C[C@@H](O)[C@](C)(C=O)[C@]1([H])C5=O)C(=O)N4)OC)cc3)[C@]1([H])[C@@H](C)C[C@@H](C)C[C@@]1(C)[C@@H]2C(C)=O |r|
[H][C@]12[C@H]3Oc4ccc(C[C@]5(O)NC(=O)\C([C@H]5OC)=C5\O[C@@H](C)[C@@]6(C)C=C(C)[C@]([H])([C@@]3([H])[C@@]56[H])[C@]1(C)C[C@H](C)C[C@@H]2C)cc4 |r,t:18,25|
[H][C@]12[C@H]3Oc4ccc(CC5NC(=O)[C@@]6(C[C@@H](O)[C@@]7(C)C=C(C)[C@]([H])([C@@]3([H])[C@@]7([H])C6=O)[C@]1(C)C[C@H](C)C[C@@H]2C)[C@@H]5OC)cc4 |r,t:19|
[H][C@]12[C@H]3Oc4ccc(CC5NC(=O)[C@@]6(C[C@H](O)[C@@]7(C)C=C(C)[C@]([H])([C@@]3([H])[C@@]7([H])C6=O)[C@]1(C)C[C@H](C)C[C@@H]2C)[C@@H]5OC)cc4 |r,t:19|
[H][C@]12[C@@H]3Oc4ccc(CC5NC(=O)[C@@]6(C[C@H](O)[C@@](C)(C=C(C)[C@@]1([H])[C@]1(C)C[C@H](C)C[C@H](C)[C@@]31[H])[C@]2([H])C6=O)[C@@H]5O)cc4 |r,t:19|
[H][C@]12[C@@H]3Oc4ccc(C[C@@]5(O)CC(C(=O)N5)=C(O)[C@]5([H])[C@]3([H])[C@@]([H])(C(C)=C[C@]5(C)C=C)[C@]1(C)C[C@H](C)C[C@@H]2C)cc4 |r,c:27|
[H][C@]12[C@H](Cc3ccc(O[C@@H]4[C@]5([H])[C@@H](C)C[C@@H](C)C[C@@]5(C)[C@]5([H])C(C)=C[C@](C)(C=C)[C@]([H])(C1=O)[C@@]45[H])cc3)C(=O)NC2=O |r,c:24|
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)CCc1c[nH]c2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OC(F)(F)C(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
COc1ccc(Cn2nnc(CC(=O)N[C@@H](CCC(=O)OCc3ccccc3)C(=O)N[C@@H](Cc3ccc(OCC(O)=O)cc3)C(=O)C[C@@H](CC(C)C)C(N)=O)n2)cc1
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)CCN1CCc2cc(C)ccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)CCCc1c[nH]c2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)CCc1cccc2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(cc1)C(F)(F)C(O)=O)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CNC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)Cn1cc(C)c(=O)[nH]c1=O)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)COc1ccc2ccccc2c1)C(N)=O
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)C(CNC(=O)OCc1ccccc1)CNC(=O)OCc1ccccc1)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NS(=O)(=O)CCc1cccc2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)COc1cccc2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(OCC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)CCc1c2ccccc2cc2ccccc12)C(N)=O
CC(C)C[C@H](CC(=O)[C@H](Cc1ccc(CC(O)=O)cc1)NC(=O)[C@H](CCC(=O)OCc1ccccc1)NC(=O)OCC1c2ccccc2-c2ccccc12)C(N)=O
COc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)ccc1C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(CC(=O)N1CCCCC1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
Cc1cc(ccc1OCC(O)=O)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1c(F)cc(cc1F)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1OC(F)(F)F)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(c(Br)c1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)c1ccc(cc1)-c1csnn1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(NC(=O)c2ccccc2)cc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
CC(=O)c1cccc(CN(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)S(=O)(=O)c2ccc(OCC(O)=O)cc2)c1
CN(Cc1ccccc1)C(=O)CN(Cc1ccc(OCC(O)=O)cc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1F)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1cccs1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
CN(Cc1ccccc1)C(=O)CN(Cc1ccc(c(Br)c1)C(F)(F)P(O)(O)=O)S(=O)(=O)c1ccc(OCC(O)=O)cc1
CC(=O)NCCN(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)S(=O)(=O)c1ccc(OCC(O)=O)cc1
OC(=O)COc1ccc(cc1C(F)(F)F)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
Oc1ccc(cc1)C(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
CS(=O)(=O)Nc1ccc(CN(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1
OP(O)(=O)C(F)(F)C(=O)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2[N+]([O-])=O)cc1
CN(Cc1ccccc1)C(=O)CN(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)S(=O)(=O)c1ccc(OCC(O)=O)cc1
OP(O)(=O)C(F)(F)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2[N+]([O-])=O)cc1
OP(O)(=O)C(F)(F)c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2)cc1
OC(=O)c1cc(ccc1O)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1c(F)ccc(c1F)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
CN(C)S(=O)(=O)c1ccc(CN(Cc2ccc(c(Br)c2)C(F)(F)P(O)(O)=O)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1
OC(=O)COc1ccc(cc1Cl)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1Br)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
Cc1cc(cc(C)c1OCC(O)=O)S(=O)(=O)N(Cc1ccccc1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1ccc(CNCc2ccc(cc2)-c2csnn2)cc1
COc1cc(CN(Cc2ccc(cc2)S(=O)(=O)N(C)C)S(=O)(=O)c2ccc(OCC(O)=O)cc2)ccc1C(F)(F)P(O)(O)=O
CN(C)S(=O)(=O)c1ccc(CN(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1
OC(=O)COc1ccc(cc1)C(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)P(O)(O)=O
CC(C)CC(C(=O)NC(CC(O)=O)c1ccccc1)c1ccc(OCc2cccc3c(cc(C(=O)c4ccccc4)n23)C#N)cc1
CC(C)C[C@H](Oc1cccc2c(cc(C(=O)c3ccccc3)n12)C#N)C(=O)NC(CC(O)=O)c1ccccc1
CC(C)CC(C(=O)NC(CC(O)=O)c1ccccc1)c1ccc2c(cc(C(O)=O)n2c1)C#N
CC(C)C[C@H](NC(=O)c1ccc2c(cc(C(O)=O)n2c1)C#N)C(=O)NC(CC(O)=O)c1ccccc1
CC(C)C[C@H](Oc1cccc2c(cc(C(O)=O)n12)C#N)C(=O)NC(CC(O)=O)c1ccccc1
CCOC(=O)c1cc(C#N)c2cccc(O[C@@H](CC(C)C)C(=O)NC(CC(O)=O)c3ccccc3)n12
CC(C)C[C@H](NC(=O)c1ccn2c(cc(C#N)c2c1)C(O)=O)C(=O)NC(CC(O)=O)c1ccccc1
COc1ccc(cc1)-c1nocc2c(ccc12)C(=O)c1ccc(Cl)cc1Cl
OC(=O)COc1ccc(cc1)-c1nocc2c(ccc12)C(=O)c1cccc(c1)C(F)(F)F
COc1cccc(c1)C(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1
COc1ccc(cc1)C(=O)c1ccc2c(nocc12)-c1cc(Br)c(OCC(O)=O)c(Br)c1
OC(=O)C(Oc1ccc(cc1)-c1nocc2c(ccc12)C(=O)C1CCCC1)C(O)=O
CCCCCCCCCCCCCCC(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1
COc1ccc(CC(=O)c2ccc3c(nocc23)-c2ccc(OCC(O)=O)cc2)cc1
NCc1ccc(cc1)C(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1
COc1ccc(cc1)C(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1
COc1ccc(cc1)C(=O)c1ccc2c(nocc12)-c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1
CCCCCCCCCCCCCCc1ccc(cc1)C(=O)c1ccc2c(nocc12)-c1ccc(OCC(O)=O)cc1
COc1ccc(cc1)C(=O)c1ccc2c(nocc12)-c1ccc(OCC(=O)N2CCN(Cc3ccccc3)CC2)cc1
CC1(CCN(CC1)c2cnc(c(n2)N)Sc3cccc(c3Cl)Cl)CN
CC1(N)CCN(CC1)c1cnc(c(N)n1)-c1cccc(Cl)c1Cl
CCCCCCCCCCCCCCCC(=O)c1c(O)oc(CO)c1O
[#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|
CC1=C[C@@H]([C@H]([C@@H](C1)c1ccc(O)cc1O)C(=O)c1ccc(O)cc1O)c1c(O)ccc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)c1O |t:1|
CC1=C[C@H]([C@H]([C@@H](C1)c1ccc(O)cc1O)C(=O)c1ccc(O)cc1O)c1c(O)cc(cc1O)-c1cc2ccc(O)cc2o1 |t:1|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6]-1=[#6]-[#6@@H](-[#6@H](-[#6@@H](-[#6]-1)-c1ccc(-[#8])cc1-[#8])-[#6](=O)-c1ccc(-[#8])cc1-[#8])-c1c(-[#8])cc2-[#8]-[#6@@H](-[#6]-[#6](=O)-c2c1-[#8])-c1cc(-[#8])ccc1-[#8] |t:6|
CC1(C)Oc2cc3oc(cc3cc2CC1O)-c1cc(O)cc(O)c1
CC(C)(O)C1Cc2cc3cc(oc3cc2O1)-c1cc(O)cc(O)c1
CC(C)C1=C(Nc2ccccc2)c2ccc3c(CCCC3(C)C)c2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccc(Br)cc2)c2ccccc2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccc(NC(C)=O)cc2)c2ccc3c(CCCC3(C)C)c2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccc(F)cc2)c2ccc3c(CCCC3(C)C)c2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccc(NC(C)=O)cc2)c2ccccc2C(=O)C1=O |c:3|
CC(C)C1=C(c2ccccc2)c2ccc3c(CCCC3(C)C)c2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccc(F)cc2)c2ccccc2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccccc2)c2ccccc2C(=O)C1=O |c:3|
CC(C)C1=C(Nc2ccc(cc2)[N+]([O-])=O)c2ccccc2C(=O)C1=O |c:3|
CC(C)C1=C(Nc2ccc(C)cc2)c2ccccc2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccccc2)c2ccc3c(CCCC3(C)C)c2C(=O)C1=O |c:3|
CC(C)C1=C(Sc2ccc(Br)cc2)c2ccc3c(CCCC3(C)C)c2C(=O)C1=O |c:3|
COc1cc(C)c(Oc2cc(C)cc(O)c2O)c(O)c1
COc1cc(C)c(Oc2cc(C)cc(O)c2)c(O)c1
COC(=O)[C@@]12Oc3cccc(Oc4ccc5O[C@]6([C@H](O)[C@@H](C)CC(O)=C6C(=O)c5c4O)C(=O)OC)c3C(=O)C1=C(O)C[C@H](C)[C@@H]2O |r,c:24,t:43|
COC(=O)[C@@]12Oc3ccc(c(O)c3C(=O)C1=C(O)C[C@H](C)[C@@H]2O)-c1ccc2O[C@]3([C@H](O)[C@@H](C)CC(O)=C3C(=O)c2c1O)C(=O)OC |r,c:38,t:17|
COC(=O)[C@@]12Oc3ccc(c(O)c3C(=O)C1=C(O)C[C@H](C)[C@@H]2O)-c1ccc(O)c2C(=O)C3=C(O)C[C@H](C)[C@@H](O)[C@@]3(Oc12)C(=O)OC |r,c:34,t:17|
COc1ccc(cc1)C1CC(=NO1)c1cc(OC)c2occc2c1OC |c:11|
COC(=O)C1C(ON=C1c1ccc2occc2c1OC)c1ccccc1 |c:7|
COc1cc(C2=NOC(C2)c2ccccc2)c(OC)c2ccoc12 |t:5|
COC(=O)C1=C/c2c([nH]c3ccccc23)\C(=C/c2c\1[nH]c1ccccc21)C(=O)OC |c:17,t:4|
CC1(C)Cc2c(sc(NC(=O)C(O)=O)c2C(O)=O)C(C)(C)C1
CNC(=O)[C@H](Cc1ccc(NS(O)(=O)=O)cc1)NC(=O)OC(C)(C)C |r|
COC(=O)C(Cc1ccccc1)(Cc2ccc(cc2)NS(=O)(=O)O)C(=O)OC
CCOC(=O)C(Cc1ccc(NS([O-])(=O)=O)cc1)(NC(=O)OCc1ccccc1)C(=O)OC
CCOC(=O)CC(Cc1ccc(NS([O-])(=O)=O)cc1)(C(=O)OC)C(=O)OC
COC(=O)C(CCCc1ccccc1)(Cc1ccc(NS([O-])(=O)=O)cc1)C(=O)OC
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Clc1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1ccccc1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Brc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
O=C1C[C@@H](c2ccc(C[C@H](NS(=O)(=O)c3ccccc3)c3nc4ccccc4[nH]3)cc2)S(=O)(=O)[N-]1
Cc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)[N-]S1(=O)=O
CC(C)(C)c1cccc2[nH]c(nc12)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
Fc1cccc(F)c1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Clc1ccc2nc([nH]c2c1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
Brc1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1ccc2nc([nH]c2c1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
O=C1CC(c2ccc(CC(NS(=O)(=O)c3ccccc3C#N)c3nc4ccccc4[nH]3)cc2)S(=O)(=O)N1
Clc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
O=C1CC(c2ccc(CC(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)c3nc4ccc(cc4[nH]3)C#N)cc2)S(=O)(=O)N1
Fc1ccc(c(F)c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Brc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1C1CC(=O)[N-]S1(=O)=O
O=C1CC(c2ccc(CC(NS(=O)(=O)c3ccc(cc3)-c3ccccc3)c3nc4ccccc4[nH]3)cc2)S(=O)(=O)N1
Clc1ccc(cc1Cl)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
FC(F)(F)c1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1cc(C[C@H](NS(=O)(=O)c2ccc(Br)c(c2)C(F)(F)F)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)[N-]S1(=O)=O
COc1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Clc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)[N-]S1(=O)=O
COc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1C1CC(=O)[N-]S1(=O)=O
FC(F)(F)c1ccc2nc([nH]c2c1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
Clc1ccc(c(Cl)c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Clc1cccc(Cl)c1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1[C@H]1CC(=O)[N-]S1(=O)=O
CC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1 |r|
Fc1ccc2nc([nH]c2c1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
Cc1cc(C[C@H](NS(=O)(=O)c2cccc(Cl)c2)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)[N-]S1(=O)=O
Clc1ccc(Cl)c(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Clc1cccc(c1Cl)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
COc1ccc2nc([nH]c2c1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1ccc(F)c(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
CC(=O)N[C@@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1cc(C[C@H](NS(=O)(=O)c2cccc(c2)C(F)(F)F)c2nc3ccc(Cl)cc3[nH]2)ccc1C1CC(=O)[N-]S1(=O)=O
O=C1CC(c2ccc(CC(NS(=O)(=O)c3ccc(cc3)C#N)c3nc4ccccc4[nH]3)cc2)S(=O)(=O)N1
Brc1ccccc1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1cc(F)cc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1ccc(cc1F)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Fc1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Oc1cccc2[nH]c(nc12)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
FC(F)(F)c1ccccc1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Clc1ccccc1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1ccc(cc1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1ccccc1S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
COC(=O)c1ccc2nc([nH]c2c1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
Cc1cccc2[nH]c(nc12)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1ccc(cc1)-c1ccccc1
Clc1cc(Cl)cc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
Cc1cc(C[C@H](NS(=O)(=O)c2ccccc2C#N)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)[N-]S1(=O)=O
Fc1cccc(c1)S(=O)(=O)N[C@@H](Cc1ccc([C@@H]2CC(=O)[N-]S2(=O)=O)c(F)c1)c1nc2ccccc2[nH]1
O=C(CCc1ccccc1)N[C@@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
CS(=O)(=O)N[C@@H](Cc1ccc(cc1)[C@@H]1CC(=O)NS1(=O)=O)c1nc2ccccc2[nH]1
FC(F)(F)c1ccc(cc1)-c1ccc(-[#8]-[#6]-c2ccc(Cl)cc2)c(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c1
[#8]-c1c(Cl)cc(cc1Cl)-c1ccc(-[#8]-[#6]-c2ccc(Cl)cc2)c(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c1
[#8]-c1c(Cl)cc(cc1Cl)-c1ccc(-[#8]-[#6]-c2ccccc2)c(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c1
[#8]-c1c(Cl)cc(cc1Cl)-c1ccc(-[#8]-[#6]-c2cc(F)cc(F)c2)c(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c1
[#8]-c1c(Cl)cc(cc1Cl)-c1cc(-[#8]-[#6]-c2ccc(Cl)cc2)cc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c1
[#8]-c1c(Cl)cc(cc1Cl)-c1cc(\[#6]=[#6]-2/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)ccc1-[#8]-[#6]-c1ccc(Cl)cc1
[#8]-c1c(Cl)cc(cc1Cl)-c1cc(-[#8]-[#6]-c2ccc(Cl)cc2)ccc1\[#6]=[#6]-1/[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-1=O
Cc1c(Br)cc(NC(=O)CS(O)(=O)=O)cc1Br
Cc1c(Br)cc(NC(=O)NS(O)(=O)=O)cc1Br
COc1ccc2C(=O)c3c(O)c(CO)c(O[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1 |r|
COc1ccc2C(=O)c3c(O)c(C)c(O[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1 |r|
COc1ccc2C(=O)c3c(O)c(C)c(O[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1O |r|
Cc1c(O)c2C(=O)c3ccc(O)c(O)c3C(=O)c2cc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O |r|
COc1ccc2C(=O)c3c(O)c(CO)c(O[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1O |r|
COc1ccc2C(=O)c3c(O)c(CO[C@@H]4O[C@H](CO[C@@H]5OC[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)c(O)cc3C(=O)c2c1 |r|
OC[C@H]1O[C@@H](OCc2c(O)cc3C(=O)c4ccccc4C(=O)c3c2O)[C@H](O)[C@@H](O)[C@@H]1O |r|
COc1ccc2C(=O)c3c(O)c(CO)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1 |r|
COc1ccc2C(=O)c3c(O)c(CO)c(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc3C(=O)c2c1O |r|
Cc1c(O)c2C(=O)c3ccccc3C(=O)c2cc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O |r|
OC[C@H]1O[C@@H](Oc2cc3C(=O)c4ccccc4C(=O)c3c(O)c2CO)[C@H](O)[C@@H](O)[C@@H]1O |r|
CC[C@H](C)[C@H](NC(=O)N[C@H]1CCCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC1=O)C(C)C)C(O)=O
CC[C@H](C)[C@H](NC(=O)N[C@H]1CCCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](CC(=O)c2ccccc2NC(N)=O)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC1=O)C(C)C)C(O)=O
CC[C@H](C)[C@H](NC(=O)N[C@H]1CCCCNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2c[nH]c3ccccc23)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC1=O)[C@@H](C)CC)C(O)=O
Oc1c(cc(c2cccnc12)S(O)(=O)=O)\N=N\c1ccc2cc(ccc2c1)S(O)(=O)=O
OC(=O)c1cccc(N\N=C2/C(=O)Nc3ccc(cc23)S(=O)(=O)NCc2ccc(F)cc2)c1
OS(=O)(=O)c1ccc(N\N=C2\C(NN(C2=O)c2ccccc2)c2ccc(cc2)[N+]([O-])=O)cc1
CCOC(=O)c1ccc(cc1)N1NC(\C(=N\Nc2ccc(cc2)S(O)(=O)=O)C1=O)c1ccc(cc1)[N+]([O-])=O
Cn1cc(-c2cn(CC(=O)Nc3nc4ccccc4s3)nn2)c2cc(C(O)=O)c(O)cc12
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(F)cc2)=C\c2cccc(Oc3ccccc3)c2)cc1
CCc1ccc(nc1)CCOc2ccc(cc2)C[C@@H]3C(=O)NC(=O)S3
CN(CCOc1ccc(cc1)C[C@H]2C(=O)NC(=O)S2)c3ccccn3
OC(=O)c1ccc(CN2C(=S)S\C(=C/c3cccc(OCCc4ccccc4)c3)C2=O)cc1
COc1cc(\C=C2/SC(=S)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1OCc1ccccc1
Cc1cc(OCc2ccc(cc2)C(O)=O)ccc1\C=C1/SC(=S)N(Cc2ccc(cc2)C(O)=O)C1=O
c1c(cc2c(c1O)C(=O)c3cc(c(cc3O2)O)O)O
Oc1cc(Cc2cc(O)c(Br)c(Br)c2Br)c(Br)c(Br)c1O
[H][C@@]1(CCC2C3CC=C4C(C)(C)c5c(C[C@]4(C)C3CC[C@]12C)cnn5-c1ccc(F)cc1)[C@H](C)CCC(O)=O |r,t:7|
COc1cc(CBr)c(C(=O)c2cc(OC)c(OC)c(Br)c2Br)c(Br)c1OC
O=c1cc(oc2cc3occc3cc12)-c1ccccc1
COc1ccc(cc1)-c1cc(=O)c2cc3ccoc3cc2o1
CC(=O)c1cc2cc(oc2cc1O)-c1coc2cc(O)c(cc12)C(C)=O
CC(=O)c1c(O)ccc2cc(oc12)-c1coc2c(C(C)=O)c(O)ccc12
CC(=O)c1ccc2oc(cc2c1O)-c1coc2ccc(C(C)=O)c(O)c12
COc1cc(O)cc(CCc2ccc(O)c(OC)c2)c1
COc1cc(CCc2cc(O)cc(O)c2)ccc1O
COC(=O)c1ccc(cc1)[C@@](C\C=C\c2ccccc2)(Cc3ccc(cc3)C(F)(F)P(=O)(O)O)n4c5ccccc5nn4
Cc1noc(n1)-c1ccc(cc1)C(C\C=C\c1ccccc1)(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)n1nnc2ccccc12
COC(=O)C(O)c1ccc(NC(=O)CCCCn2cc(COc3ccc(cc3)-c3cc(no3)C(O)=O)nn2)cc1
CCCCCCCCCCCCCCC(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(N)=O |r|
OP(O)(=O)C(F)(F)c1ccc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)Cc2ccccc2)C(=O)Cc2ccccc2)cc1
CC(C)OC(=O)c1cc(CC(Cc2ccc(cc2)C(F)(F)P(O)(O)=O)(C(=O)c2ccccc2)c2ccccc2)ccc1C(F)(F)P(O)(O)=O
CCc1cc(Br)ccc1S(=O)(=O)N(Cc1ccc(cc1)C(=O)C(F)(F)P(O)(O)=O)Cc1ccc(cc1)C(=O)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)C(=O)c1ccc(CN(Cc2ccc(cc2)C(=O)C(F)(F)P(O)(O)=O)S(=O)(=O)c2ccc(Br)cc2OC(F)(F)F)cc1
OP(O)(=O)C(F)(F)C(=O)c1ccc(CN(Cc2ccc(cc2)C(=O)C(F)(F)P(O)(O)=O)S(=O)(=O)c2cc(F)ccc2F)cc1
Cc1ccccc1S(=O)(=O)N(Cc1ccc(cc1)C(=O)C(F)(F)P(O)(O)=O)Cc1ccc(cc1)C(=O)C(F)(F)P(O)(O)=O
Cc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)C(F)(F)P(O)(O)=O)Cc1ccc(cc1)C(=O)C(F)(F)P(O)(O)=O
C\C(\C=C(/C)C(O)=O)=C/c1csc(n1)[C@@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CC1CCCCC1 |r|
OC(=O)c1ccc(CCNC(=O)c2cc(NC(=O)CCc3ccc(cc3)C(F)(F)P(O)(O)=O)cc(NC(=O)CCc3ccc(cc3)C(F)(F)P(O)(O)=O)c2)cc1
CCCCCCCC\C(=C/Cn1oc(=O)[nH]c1=O)c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
CCCCCCCC\C(=C\Cn1oc(=O)[nH]c1=O)c1cccc(OCc2nc(oc2C)-c2ccc(cc2)C(F)(F)F)c1
[O-][N+](=O)c1cc(ccc1Oc1ccc(cc1)S(=O)(=O)c1ccc(Oc2ccc(cc2[N+]([O-])=O)S(=O)(=O)C(F)(F)F)cc1)S(=O)(=O)C(F)(F)F
OC(=O)\C=C\c1ccc(cc1)-c1nc([nH]c1-c1ccc(\C=C\C(O)=O)cc1)-c1ccc(cc1)C(O)=O
Oc1c(Br)cc(-c2ncc(s2)-c2ccccc2)c(Br)c1O
CCCCCCCCc1ccc(cc1)-n1c(C)ccc1-c1ccc(O[C@@H](Cc2ccccc2)C(O)=O)cc1 |r|
CCCCCNC(=O)[C@H](Cc1cccc(OCC(O)=O)c1C(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Oc1ccccc1 |r|
OC(=O)C(=O)c1sc2[C@@H](CNCc3ccc(O)cc3)NCCc2c1C(O)=O |r|
CC(C)(C)OC(=O)COc1ccc(CC2=C(c3c[nH]c4ccccc34)c3ccccc3C(=O)C2=O)cc1 |c:14|
Cc1sc2c(Br)c3ccccc3c(-c3cc(C)c(O[C@@H](Cc4ccccc4)C(O)=O)c(C)c3)c2c1C |r|
CCCCCCCCCCCCCCOc1ccccc1NC(=O)c1cccc(F)c1C(O)=O
CCCCCCCCCCCCCCOc1ccccc1NC(=O)c1c(Cl)c(Cl)c(Cl)cc1C(O)=O
CCCCCCCCCCCCCCCCOc1ccccc1NC(=O)c1ncccc1C(O)=O
OC(=O)C(=O)Nc1sc2CC(COC3=NS(=O)(=O)c4ccccc34)OCc2c1C(O)=O |t:13|
COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1onc(C(O)=O)c1CO
COC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1onc(C(O)=O)c1N
NC(=O)[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)Cc1ccc(cc1)C(F)(F)P(O)(O)=O |r|
OP(O)(=O)C(F)(F)c1ccc(C[C@@](c2ccccc2)(c2ccc(cc2)C(F)(F)P(O)(O)=O)n2nnc3ccccc23)cc1 |r|
OP(O)(=O)C(F)(F)c1ccc(C[C@](c2ccc(cc2)C(F)(F)P(O)(O)=O)(c2ccc(F)c(F)c2)n2nnc3ccccc23)cc1 |r|
OP(O)(=O)C(F)(F)c1ccc(C[C@](\C=C\c2ccccc2)(c2nc3ccccc3s2)n2nnc3ccccc23)cc1 |r|
COC(CC(C)C)c1ccc2ccc(CC(Cc3ccc(cc3)C(F)(F)P(O)(O)=O)(c3ccccc3)n3nnc4ccccc34)c(c2n1)P(O)(O)=O
Cc1cc(\C=C2\S\C(NC2=O)=N\c2ccc(Cl)cc2)c(C)n1-c1cc(cc(c1)C(O)=O)C(O)=O
Oc1cc(CC2CCCCC2)cc(F)c1N1CC(=O)NS1(=O)=O
CS(=O)(=O)Oc1c(Cl)cccc1Cc1ccc(N2CC(=O)NS2(=O)=O)c(O)c1
Oc1cc(ccc1N1CC(=O)NS1(=O)=O)-c1ccc[nH]1
COc1ccc2cc(O)c(cc2c1)N1CC(=O)NS1(=O)=O
OP(O)(=O)C(F)(F)c1cc2ccc(cc2cc1Br)C(Cc1ccc2cc(Br)c(cc2c1)C(F)(F)P(O)(O)=O)(C(=O)c1ccccc1)n1nnc2ccccc12
O=C1N(C(=S)N\C1=C/c1ccc(cc1)-c1ccccc1)c1ccccc1
Oc1cc2oc3cc(OCc4cccc(Cl)c4F)cc(O)c3c(=O)c2cc1O
[H][C@]12CCc3cc(OCC(=O)Oc4ccccc4C(O)=O)ccc3[C@]1(C)CCC[C@]2(C)C(O)=O |r|
OC[C@@H]1[C@@H](O)[C@H](O)CN1CCCNC(=O)c1ccc(cc1)[N+]([O-])=O |r|
CC(=O)c1cc2cc(oc2cc1O)-c1cccc(Cl)c1
[H][C@]1([#6]-[#6@H](-[#8])-[#6@@H](-[#6])-c2c(-[#8])cc(-[#6])cc12)[#6@@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r|
[H][C@]1([#6]-[#6]-[#6@@H](-[#6]-[#8])-c2c(-[#8])cc(-[#6])cc12)[#6@@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r|
[#6]-[#6@@H](-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-c1cccc2c(-[#8])cc(-[#6])cc12 |r|
[H][C@@]1([#6@@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6@H](-[#8])-[#6]-[#6@@H](-[#6])-c2c(-[#8])cc(-[#6])cc12 |r|
CCCCCCCCCCCCCCCC(=O)C1=C(O)C(CO)OC1=O |c:17|
[H][C@@]12CC[C@@]3(C)C[C@@]1(CC3=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCc1ccccc1I |r,THB:10:9:1.2.3:6|
[H][C@@]12CC[C@@]3(C)C[C@@]1(CC3=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCc1ccc(Br)cc1 |r,THB:10:9:1.2.3:6|
[H][C@@]12CC[C@@]3(C)C[C@@]1(CC3=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCCN1CCNCC1 |r,THB:10:9:1.2.3:6|
[H][C@@]12CC[C@@]3(C)C[C@]1(CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC)[C@H](Br)C3=O |r|
[H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OC(=O)c1ccc(O)cc1)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.2.3:6|
[H][C@@]12CC[C@@]3(C)C[C@@]1(CC3=O)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(O)=O |r|
CCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CC[C@H](C)[C@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NC(CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CC[C@H](C)[C@H](NC(=O)C(CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)CCCCCCCCCCCCCCCCCCCCC(O)=O)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O)C(O)=O |r|
Oc1ccc(\C=C\c2cc(O)c(-c3cc(O)c(O)cc3\C=C\c3cc4oc(=O)c5cc(O)c(O)cc5c4c(=O)o3)c(=O)o2)cc1O |(4.66,-26.23,;4.66,-24.69,;3.32,-23.92,;3.33,-22.38,;4.66,-21.62,;4.66,-20.08,;3.33,-19.31,;3.33,-17.77,;2,-16.99,;2,-15.46,;.67,-14.68,;3.34,-14.69,;3.34,-13.16,;4.68,-12.39,;4.68,-10.85,;6.01,-10.07,;3.33,-10.08,;3.33,-8.54,;2.01,-10.85,;2.01,-12.38,;.67,-13.15,;-.65,-12.38,;-1.99,-13.15,;-1.99,-14.69,;-3.33,-15.46,;-3.33,-17,;-4.66,-17.77,;-4.66,-19.31,;-5.99,-17,;-7.32,-17.76,;-8.65,-17,;-9.98,-17.77,;-8.65,-15.46,;-9.98,-14.7,;-7.32,-14.68,;-5.99,-15.46,;-4.67,-14.69,;-4.67,-13.14,;-6.01,-12.38,;-3.33,-12.37,;4.67,-15.46,;6,-14.68,;4.67,-16.99,;5.99,-22.38,;6,-23.91,;7.33,-24.68,)|
OC(=O)c1cc2oc(=O)c3cc(O)c(O)cc3c2c(=O)o1
CC(C)c1nc(no1)-c1sc(Br)c(Br)c1OCC(O)=O
Cc1c(csc1-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1)N1C=C(O)NS1(=O)=O |t:34|
OC1=CN(c2csc(c2Cl)-c2cccc(NC3CCCCC3)c2)S(=O)(=O)N1 |t:1|
OC(=O)COc1c(Br)c(Br)sc1C(=O)Nc1ccn[nH]1
Cc1c(csc1-c1cccc(NC2CC(C)(C)CC(C)(C)C2)c1)N1C=C(O)NS1(=O)=O |t:27|
Cc1c(OCC(O)=O)c(sc1-c1cccc(OC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1)-c1nnn[nH]1
Cc1c(OCC(O)=O)c(sc1-c1ccccc1)-c1nnn[nH]1
OC(=O)COc1c(Br)c(Br)sc1C(O)=O
OC(=O)COc1csc(Br)c1Br
OC(=O)COc1c(Br)c(Br)sc1-c1nnn[nH]1
OC(=O)COc1c(Br)c(sc1-c1nnn[nH]1)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
OC(=O)COc1c(Br)c(Br)sc1C(=O)Nc1nccs1
OC1=CN(c2c(Cl)sc(c2Cl)-c2ccccc2)S(=O)(=O)N1 |t:1|
OCCOc1c(Br)c(Br)sc1C(O)=O
OC1=CN(c2csc(c2Br)-c2ccccc2)S(=O)(=O)N1 |t:1|
ONC(=O)COc1c(Br)c(Br)sc1C(O)=O
OC(=O)COc1c(Br)c(Br)sc1CC=C
CCc1nc(no1)-c1sc(Br)c(Br)c1OCC(O)=O
CC(=O)N(C1CC(C)(C)CC(C)(C)C1)c1cccc(c1)-c1sc(-c2nnn[nH]2)c(OCC(O)=O)c1Br
OC(=O)c1sc(Br)c(Br)c1OCc1nnn[nH]1
OC(=O)COc1cc(sc1-c1nnn[nH]1)-c1ccccc1
OC(=O)COc1c(Br)c(Br)sc1C(=O)N1CCOCC1
OC(=O)COc1c(Br)c(Br)sc1C#N
Cc1c(csc1-c1ccccc1)N1C=C(O)NS1(=O)=O |t:15|
CC1(C)CC(CC(C)(C)C1)Nc1cccc(c1)-c1sc(c(OCC(O)=O)c1Br)-c1nnn[nH]1
NNC(=O)c1sc(Br)c(Br)c1OCC(O)=O
NS(=O)(=O)N(C1CCCCC1)c1cccc(c1)-c1scc(N2C=C(O)NS2(=O)=O)c1Cl |t:24|
OC(=O)c1sc(Br)c(Br)c1OCC(F)(F)F
OC(=O)COc1c(Br)c(sc1-c1nnn[nH]1)-c1ccccc1
OCC(=O)c1sc(Br)c(Br)c1OCC(O)=O
OCC(O)COc1c(Br)c(Br)sc1C(O)=O |w:2.2|
OC(=O)c1sc(Br)c(Br)c1OCC=C
OCc1sc(Br)c(Br)c1OCC(O)=O
CC(=O)Nc1sc(Br)c(Br)c1OCC(O)=O
OC1=CN(c2csc(c2Cl)-c2ccccc2)S(=O)(=O)N1 |t:1|
NC(=O)c1sc(Br)c(Br)c1OCC(O)=O
Cc1nc(no1)-c1sc(Br)c(Br)c1OCC(O)=O
OC(=O)c1sc(Br)c(Br)c1OCC#N
OC(=O)COc1c(Br)c(sc1-c1nnn[nH]1)-c1cccc(NC2CCCCC2)c1
Cc1c(csc1-c1cccc(NC2CCCCC2)c1)N1C=C(O)NS1(=O)=O |t:23|
[H][C@@]12[#6]-[#6][C@]3([#6])[C@]([H])([#6]-[#6]-[#6]4=[#6](-[#6]-[#6][C@@]34[#6])-[#6@@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[C@@]1([#6])[#6]-[#6]-[#6@@H](-[#8]-[#6](-[#6])=O)C2([#6])[#6] |r,t:10|
[H][C@@]1(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H](OC(=O)[C@]2(C)CCC[C@]3(C)[C@]2([H])CC[C@]24CC(=C)[C@H]([C@H](O)[C@@]32[H])C(=O)C4)[C@H](OC(C)=O)[C@H]1OC(C)=O |r,THB:41:40:38.36:32.33|
[H][C@@]1(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@@H](OC(=O)[C@]2(C)CCC[C@]3(C)[C@]2([H])CC[C@@]24CC(=O)[C@@H]([C@H](O)[C@@]32[H])C(C)=C4)[C@H](OC(C)=O)[C@H]1OC(C)=O |r,c:45,TLB:34:33:38.36:42.40|
[H][C@]12C[C@@]3(CC[C@]4([H])[C@@](C)(CCC[C@@]4(C)[C@]3([H])CC1)C(=O)O[C@@H]1O[C@H](CO)[C@@]([H])(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)[C@H](OC(C)=O)[C@H]1OC(C)=O)[C@@]([H])(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C2=C |r|
[H][C@@]12C[C@]3(C[C@@]1(O)CO)CC[C@]1([H])[C@@](C)(CCC[C@@]1(C)[C@]3([H])[C@@H](O)C2)C(=O)O[C@@H]1O[C@H](CO)[C@@]([H])(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@H](OC(C)=O)[C@H]1OC(C)=O |r,TLB:7:5:20.22.24:2,6:5:20.22.24:2|
CC1(C)CC(CC(C)(C)N1[O])NC(=O)\C=C\c1ccc(o1)-c1ccc(O)c(c1)C(O)=O |^1:10|
CC1(C)CC(CC(C)(C)N1[O])NCc1ccc(o1)-c1ccc(O)c(c1)C(O)=O |^1:10|
COC(=O)c1cc(ccc1O)-c1ccc(CNC2CC(C)(C)N([O])C(C)(C)C2)o1 |^1:23|
CC1(C)CC(CC(C)(C)N1[O])NC(=O)\C=C\c1ccc(o1)-c1cccc(c1)[N+]([O-])=O |^1:10|
CC1(C)CC(CC(C)(C)N1[O])NC(=O)CCCC(=O)Nc1ccc(O)c(c1)C(O)=O |^1:10|
CC1(C)CC(CC(C)(C)N1[O])NC(=O)\C=C\c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O |^1:10|
COC(=O)c1cc(NC(=O)CCCC(=O)NC2CC(C)(C)N([O])C(C)(C)C2)ccc1O |^1:22|
COc1cc(\C=C2\NC(=O)N(Cc3ccc(C)cc3)C2=O)ccc1OCc1cccc(c1)C(O)=O
COc1cc(\C=C2\NC(=O)N(Cc3ccccc3)C2=O)cc(Cl)c1OCc1cccc(c1)C(O)=O
[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]1(C)C2=CC(=O)[C@]2([H])[C@@]3(C)Cc4c([nH]c5ccc(cc45)C(F)(F)F)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12[#6][C@]1([H])[#6]-1=[#6](-[#6]-[#7]-[#6]-1=O)[C@]([H])([#6@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6@@H](-[#6]-[#6@H]2-[#6])-[#8]-[#6](-[#6])=O |r,t:6|
[H][C@@]12[#6][C@]1([H])[#6]-1=[#6](-[#6](=O)-[#7]-[#6]-1)[C@]([H])([#6@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6@@H](-[#6]-[#6@H]2-[#6])-[#8]-[#6](-[#6])=O |r,t:6|
[H][C@]1([#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6@@H](-[#8]-[#6]-[#6])-[#6]-2=[#6]1-[#6@H](-[#8])-[#7]-[#6]-2=O)[#6@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r,c:12,t:5|
[H][C@@]12[#6][C@]1([H])[#6]-1=[#6](-[#6]-[#8]-[#6]-1=O)[C@]([H])([#6@H](-[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#6@H](-[#8])-[#6]-[#6@H]2-[#6] |r,t:6|
OC(=O)CCN1C(=S)S\C(=C/c2ccc(OCCc3ccccc3)cc2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2ccc(OCCCCc3ccccc3)cc2)C1=O
OC(=O)CN1C(=S)S\C(=C/c2cccc(OCCCCc3ccccc3)c2)C1=O
OC(=O)CCN1C(=S)S\C(=C/c2ccc(OCCCCc3ccccc3)cc2)C1=O
OC(=O)CCN1C(=S)S\C(=C/c2cccc(OCCCCc3ccccc3)c2)C1=O
[#6]-[#8]-c1cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])cc1-c1cc2ccc(-[#8])cc2o1
CC1(C)Oc2ccc(-c3cc4ccc(O)cc4o3)c(O)c2C=C1 |c:24|
CC1(C)Oc2c(ccc(O)c2C=C1)-c1cc2ccc(O)cc2o1 |c:12|
COc1ccc2cc(oc2c1)-c1ccc(O)cc1OC
[#6]-[#8]-c1cc(-[#8])ccc1-c1cc2cc(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])cc2o1
CC[C@H](C)C[C@H](C)[C@@H](O)[C@@H](C)\C=C(/C)[C@@H](O)[C@@H](C)\C=C(/C)[C@@H](O)[C@@H](C)\C=C(/C)C=O |r|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3coc(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:21.18.19:22.39|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)c1c2c2c(C)cc(O)c3C(=O)Oc(c1O)c23 |r,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)c1c2c2c(C)cc(O)c3C(=O)OC(=O)c(c1O)c23 |r,THB:3:2:22.23:21.18.19|
[H][C@]1(OC(C)=O)[C@@]2([H])c3c(c(O)c(C=O)c4cc(O)cc(C)c34)[C@@]11COC(=O)c3c(O)cc(C)c(C2=O)c13 |r,TLB:2:1:9.8:35.37.34|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3c[nH]c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:22.39:21.18.19|
[H][C@]1(OC(C)=O)[C@@]2([H])c3c(c(O)c4[C@@H](OC)OC(=O)c5c(O)cc(C)c3c45)[C@@]11COC(=O)c3c(O)cc(C)c(C2=O)c13 |r,TLB:2:1:9.8:39.41.38|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)c1c2c2c(C)cc(O)c3C(=O)O[C@@H](OC)c(c1O)c23 |r,THB:3:2:19.18.21:23.22|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn(CC(O)=O)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:21.18.19:22.43|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn([C@@H](Cc4ccccc4)C(=O)OCC)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:21.18.19:22.52|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn(-c4ccc(Br)cc4)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:22.46:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn(-c4cccc(Cl)c4)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:22.46:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn(-c4ccc(C)cc4)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:22.46:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn(-c4ccc(cc4)[N+]([O-])=O)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:22.48:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)[C@@]1([H])C(=O)c3cn(-c4cccc(c4)[N+]([O-])=O)c(=O)c4c(O)cc(C)c(c34)[C@@]21OC |r,THB:3:2:22.48:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(c[nH]c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn([C@@H](Cc2ccccc2)C(=O)OCC)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(Br)cc2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cccc(Cl)c2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(C)cc2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccc2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccc2O)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(O)cc2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(OC)cc2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(OC)c(OC)c2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cc(OC)c(OC)c(OC)c2)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccc2Cl)c3=O)C1=O |r,c:25,THB:3:2:22.23:21.18.19|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(Cl)cc2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccc2F)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccc2I)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(I)cc2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccc2[N+]([O-])=O)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(O)cc2[N+]([O-])=O)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cnc4ccccc4c2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cccc4ncccc24)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc4ncccc4c2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cccc4cccnc24)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccccn2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cccnc2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ncccc2C)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cc(C)ccn2)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2ccc(cc2)[N+]([O-])=O)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12[C@H](OC(C)=O)[C@]3(COC(=O)c4c(O)cc(C)c(C1=O)c34)C1=C2c2c(C)cc(O)c3c2c(cn(-c2cccc(c2)[N+]([O-])=O)c3=O)C1=O |r,c:25,THB:3:2:19.18.21:22.23|
[H][C@@]12C[C@H](CO)C[C@H](C)[C@@]1([H])[C@@]1([H])Oc3ccc(C[C@]4(O)NC(=O)[C@@]56C(=O)[C@]7([H])[C@]1([H])[C@@]2([H])C(C)=C[C@]7(C)[C@]5([H])C(C)=CC[C@]46[H])cc3 |r,c:37,46|
[H][C@@]12O[C@]1(C)[C@H](C)C1=C(C)[C@@]3([H])[C@]4([H])C[C@H](C)C[C@H](C)[C@@]4([H])[C@@]4([H])Oc5ccc(C[C@]6(O)NC(=O)[C@]7(O[C@@]67[H])C(=O)[C@@]([H])([C@]34[H])[C@@]21C)cc5 |r,c:8|
[H][C@]12Cc3ccc(O[C@]4([H])[C@]5([H])[C@@H](C)C[C@@H](CO)C[C@@]5([H])[C@]5([H])C(C)=C6[C@@H](C)C(C)=C[C@]6(C)[C@@]([H])(C(=O)[C@]1([H])C(=O)NC2=O)[C@@]45[H])cc3 |r,c:30,t:25|
[H][C@@]12C[C@H](C)C[C@H](C)[C@@]1([H])[C@]1([H])Oc3ccc(C[C@]4(O)NC(=O)C(=C4)C(=O)[C@]4([H])[C@]1([H])[C@@]2([H])C(C)=C1[C@@H](C)C(C)=C[C@]41C)cc3 |r,c:24,43,t:38|
[H][C@]12Cc3ccc(O[C@]4([H])[C@]5([H])[C@@H](C)C[C@@H](C)C[C@@]5([H])[C@]5([H])C(C)=C6[C@@H](C)C(C)=C[C@]6(C)[C@]([H])(C(=O)[C@]1([H])C(=O)NC2=O)[C@@]45[H])cc3 |r,c:29,t:24|
[H][C@]12Cc3ccc(O[C@]4([H])[C@]5([H])[C@@H](C)C[C@@H](C)C[C@@]5([H])[C@]5([H])C(C)=C6[C@@H](C)C(C)=C[C@]6(C)[C@@]([H])(C(=O)[C@]1([H])C(=O)NC2=O)[C@@]45[H])cc3 |r,c:29,t:24|
[H][C@@]12O[C@]11C(=O)N[C@@]2(O)Cc2ccc(O[C@]3([H])[C@]4([H])[C@@H](C)C[C@@H](C)C[C@@]4([H])[C@]4([H])C(C)=C5[C@@H](C)C(C)=C[C@]5(C)[C@@]([H])(C1=O)[C@@]34[H])cc2 |r,c:38,t:33|
OC(=O)C1Nc2ccc(cc2C2C=CCC12)C(O)=O |c:13|
COc1cc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccc(cc2)C(F)(F)P(O)(O)=O)C(=O)N[C@@H](CCCCNC(=O)c2ccc(C)c(Br)c2)C(N)=O)ccc1O |r|
Oc1cc2ccc(Br)cc2c(F)c1N1CC(=O)NS1(=O)=O
OC(=O)c1cc(C=O)cc(C2CCCO2)c1O |w:10.9|
OC(=O)c1cc(Br)cc(Cc2cc(Br)cc(C(O)=O)c2O)c1O
OC(=O)c1cccc(-c2ccccc2)c1O
OC(=O)c1cc(Cc2ccccc2)cc(Cc2ccccc2)c1O
OC(=O)c1cc(F)ccc1O
c1ccc2cc(c(cc2c1)C(=O)O)O
OC(=O)c1cc(cc(Cc2cc(cc(C(O)=O)c2O)-c2cccs2)c1O)-c1cccs1
c1ccc2c(c1)ccc(c2O)C(=O)O
OC(=O)c1cc(F)cc(Cc2cc(F)cc(C(O)=O)c2O)c1O
OC(=O)c1cc(Cc2ccccc2)cc(Br)c1O
OC(=O)c1cc(cc(Cc2cc(cc(C(O)=O)c2O)-c2ccco2)c1O)-c1ccco1
OC(=O)c1cc(cc(Br)c1O)-c1ccccc1
OC(=O)c1cc(cc(Cc2cc(cc(C(O)=O)c2O)-c2ccccc2)c1O)-c1ccccc1
OC(=O)c1cccc(Br)c1O
OC(=O)c1cc(cc(Cc2ccccc2)c1O)-c1ccccc1
OC(=O)c1cc(Cc2ccccc2)ccc1O
OC(=O)c1cc(C=O)ccc1O
OC(=O)Cc1cc(O)c(CC(O)=O)cc1O
OC(=O)c1cc(Br)cc(Cc2ccccc2)c1O
OC(=O)c1cc(ccc1O)S(O)(=O)=O
OC(=O)c1cccc(Cc2ccccc2)c1O
OC(=O)c1cc(Cc2ccccc2)cc(c1O)-c1ccccc1
OC(=O)c1cc(ccc1O)-c1ccccc1
OC(=O)c1cc(cc(-c2ccccc2)c1O)-c1ccccc1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC(=O)c2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(OCC2CCN(CC2)C(=O)Nc2ccccc2)c1
COC(=O)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NCC2CCN(CC2)C(=O)Nc2ccccc2Cl)c1
CC1(C)CC(CC(C)(C)C1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NCc2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NCC2CCN(CC2)S(=O)(=O)c2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)c2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1ccccc1
Nc1ccccc1CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCCCCC2)c1
CCC(=O)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(OC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(OCc2ccccc2)c1
CCNC(=O)Nc1ccccc1CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
CC(=O)Nc1ccccc1CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2C(F)(F)F)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCCC2)c1
Cc1c(OCC(O)=O)c(sc1-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1)C(O)=O
Cc1ccccc1CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCOCC2)c1
Cc1cccc(C)c1CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2Cl)c1
COc1ccccc1NC(=O)N1CCC(CNc2cccc(c2)-c2sc(C(O)=O)c(OCC(O)=O)c2Br)CC1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NCC2CCN(CC2)C(=O)Nc2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccc(Cl)cc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NCC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
Cc1ccccc1NC(=O)N1CCC(CNc2cccc(c2)-c2sc(C(O)=O)c(OCC(O)=O)c2Br)CC1
CC(C)NC(=O)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2cccc(Cl)c2)c1
CC(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCCCC2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(O)c1
Cc1cccc(C)c1NC(=O)N1CCC(CNc2cccc(c2)-c2sc(C(O)=O)c(OCC(O)=O)c2Br)CC1
CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)C(=O)NCc2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NCC2CCCCC2)c1
COC(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
CS(=O)(=O)Nc1ccccc1CS(=O)(=O)N1CCC(CC1)Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1c(Cl)c(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
Nc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)COc1cc(sc1C(O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1cccc(NC2CCNCC2)c1
COc1cccc(c1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4F)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4cccc(F)c4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccc(F)cc4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4Br)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4cccc(Br)c4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccc(Br)cc4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4Cl)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4cccc(Cl)c4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccc(Cl)cc4)s3)cc2)S1
Cc1ccccc1CSc1nnc(NC(=O)c2ccc(/C=C3/SC(=O)NC3=O)cc2)s1
Cc1cccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)c1
Cc1ccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)cc1
COc1cccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)c1
N#Cc1ccccc1CSc1nnc(NC(=O)c2ccc(/C=C3/SC(=O)NC3=O)cc2)s1
N#Cc1cccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)c1
N#Cc1ccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)cc1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4[N+](=O)[O-])s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4cccc([N+](=O)[O-])c4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccc([N+](=O)[O-])cc4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4C(F)(F)F)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4cccc(C(F)(F)F)c4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(C(F)(F)F)cc4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4OC(F)(F)F)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4cccc(OC(F)(F)F)c4)s3)cc2)S1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccc(OC(F)(F)F)cc4)s3)cc2)S1
COC(=O)c1ccccc1CSc1nnc(NC(=O)c2ccc(/C=C3/SC(=O)NC3=O)cc2)s1
COC(=O)c1cccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)c1
COC(=O)c1ccc(CSc2nnc(NC(=O)c3ccc(/C=C4/SC(=O)NC4=O)cc3)s2)cc1
O=C1NC(=O)/C(=Cc2ccc(C(=O)Nc3nnc(SCc4ccccc4-c4ccccc4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(-c5ccccc5)cc4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(F)cc4Cl)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(F)cc4F)s3)cc2)S1
CC(C)(C)c1ccc(CSc2nnc(NC(=O)c3ccc(/C=C4SC(=O)NC4=O)cc3)s2)cc1
CS(=O)(=O)c1ccc(CSc2nnc(NC(=O)c3ccc(/C=C4SC(=O)NC4=O)cc3)s2)cc1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(F)c(F)c4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(F)c(Cl)c4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc(F)c(F)c4F)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc5ncccc5c4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4cc(C(F)(F)F)cc(C(F)(F)F)c4)s3)cc2)S1
O=C1NC(=O)/C(=C/c2ccc(C(=O)Nc3nnc(SCc4ccc5ccccc5c4)s3)cc2)S1
O=P(O)(O)C(F)(F)c1cc(Br)c2cn[nH]c2c1
O=P(O)(O)C(F)(F)c1ccc2occc2c1
O=P(O)(O)C(F)(F)c1ccc2sccc2c1
O=P(O)(O)C(F)(F)c1cc(Cl)c2ncccc2c1
O=P(O)(O)C(F)(F)c1ccc2sc3ccc(Br)cc3c2c1
O=P(O)(O)C(F)(F)c1ccc2c(c1)C(F)(F)c1cc(Br)ccc1-2
O=P(O)(O)C(F)(F)c1cccc2oc3ccccc3c12
C=C(c1ccccc1)c1ccc(C(F)(F)P(=O)(O)O)c2c1oc1ccccc12
CC(C)CCN[C@@H]1CCc2cc(c(c(c2C1)F)N3CC(=O)NS3(=O)=O)O
CCN1CCc2cc(O)c(N3CC(=O)NS3(=O)=O)c(F)c2CC1
Cc1nc(sc1CCOc1ccc2n(Cc3ccccc3)cc(c2c1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:25.29|
Cc1nc(sc1CCOc1cc(ccc1OCCc1ccccc1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:24.27|
COCn1cc(c2cccc(OCc3ccccc3)c12)C(O)(C(O)=O)C(F)(F)F |w:20.23|
COCn1cc(c2ccc(OCc3ccccc3)cc12)C(O)(C(O)=O)C(F)(F)F |w:20.23|
COC(=O)c1c(O)cccc1OCCOc1ccc2n(COCC[Si](C)(C)C)cc(c2c1)C(O)(C(O)=O)C(F)(F)F |w:32.35|
Cc1nc(sc1CCOc1cc(ccc1OCc1ccccc1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:23.26|
Cc1nc(sc1CCOc1cc(ccc1OCc1ccncc1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:23.26|
Cc1nc(sc1CCOc1cc(ccc1OCc1ccc(F)cc1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:24.27|
Cc1nc(sc1CCOc1cc(ccc1OCC(O)=O)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:20.22|
CCCCCOc1ccc(cc1OCCc1sc(nc1C)-c1ccc(Cl)cc1)C(O)(C(O)=O)C(F)(F)F |w:28.31|
Cc1nc(sc1CCOc1cc(ccc1O)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:16.18|
Cc1nc(sc1CCOc1cccc(c1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:15.17|
Cc1nc(sc1CCOc1ccc2n(COCC[Si](C)(C)C)cc(c2c1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1 |w:26.29|
COCn1cc(c2cc(OCCc3sc(nc3C)-c3ccc(Cl)cc3)ccc12)C(O)(C(O)=O)C(F)(F)F |w:28.32|
COc1ccc(COc2ccc(cc2OCCc2sc(nc2C)-c2ccc(Cl)cc2)C(O)(C(O)=O)C(F)(F)F)cc1 |w:30.33|
OP(O)(=O)C(F)(F)c1ccc(cc1)C(C(=O)c1ccccc1)c1ccccc1
OC(=O)c1cc2oc3c(Oc4ccc(cc4O)-c4ccc(OS(O)(=O)=O)c(O)c4)cc(O)cc3c2cc1O
OC(=O)c1cc2oc3c(Oc4ccc(cc4O)-c4ccc(O)c(O)c4)cc(O)cc3c2cc1O
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)c2ncc(CCCOc3cccc(O)c3C(O)=O)[nH]2)ccc1C1CC(=O)NS1(=O)=O |w:5.5|
NC(=O)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1cccc(c1)C(F)(F)F |w:11.11,3.20|
COC(=O)c1c(O)cccc1OCCCc1cnc([nH]1)C(Cc1ccc(C2CC(=O)NS2(=O)=O)c(C)c1)NS(=O)(=O)c1cccc(F)c1 |w:20.40|
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)C2=NC[C@@H](CCCOc3cccc(c3)S(C)(=O)=O)N2)ccc1C1CC(=O)NS1(=O)=O |w:5.5,t:18|
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)C2=NC[C@@H](CCCCOc3cccc(O)c3C(O)=O)N2)ccc1C1CC(=O)NS1(=O)=O |w:5.5,t:18|
C[C@@H]1CN=C(N1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1cccc(c1)C(F)(F)F |w:6.24,c:3|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@H](Cc2ccccc2)N1 |w:14.14,t:33|
CC1(C)CN=C(N1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1cccc(c1)C(F)(F)F |w:7.25,c:4|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc(c[nH]1)-c1ccccc1 |w:11.11|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(Cc2ccccc2)[nH]1 |w:11.11|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(Cc2ccccc2)[nH]1 |w:14.14|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(CCc2ccccc2)[nH]1 |w:11.11|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc[nH]1 |w:22.23,14.14|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(CCc2ccccc2)[nH]1 |w:14.14|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@@H](Cc2ccccc2)N1 |w:11.11,t:30|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(CCCc2ccccc2)[nH]1 |w:11.11|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@@H](N1)c1ccccc1 |w:14.14,t:33|
COC(=O)c1c(O)cccc1OCCCCc1cnc([nH]1)C(Cc1ccc(C2CC(=O)NS2(=O)=O)c(C)c1)NS(=O)(=O)c1cccc(F)c1 |w:21.41|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1nc(c[nH]1)-c1ccccc1 |w:14.14|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(CCCCc2ccccc2)[nH]1
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@@H](Cc2ccccc2)N1 |w:14.14,t:33|
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)C2=NC[C@@H](CCOc3cccc(c3)S(C)(=O)=O)N2)ccc1C1CC(=O)NS1(=O)=O |t:18|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NCCN1 |w:14.14,t:33|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(CCCc2ccccc2)[nH]1 |w:14.14|
COC(=O)c1c(O)cccc1OCCCC[C@@H]1CN=C(N1)C(Cc1ccc(C2CC(=O)NS2(=O)=O)c(C)c1)NS(=O)(=O)c1cccc(F)c1 |w:21.41,c:19|
C[C@H]1CN=C(N1)C(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)NS(=O)(=O)c1cccc(c1)C(F)(F)F |w:6.24,c:3|
FC(F)(F)c1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@H](N1)c1ccccc1 |w:14.14,t:33|
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)C2=NC[C@@H](COc3cccc(c3)S(C)(=O)=O)N2)ccc1C1CC(=O)NS1(=O)=O |t:18|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@@H](CCc2ccccc2)N1 |w:11.11,t:30|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)C1=NC[C@@H](Cc2ccccc2F)N1 |w:11.11,t:30|
Fc1cccc(c1)S(=O)(=O)NC(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)c1ncc(CCCCc2ccccc2)[nH]1 |w:11.11|
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)c2ncc(CCCCOc3cccc(O)c3C(O)=O)[nH]2)ccc1C1CC(=O)NS1(=O)=O |w:5.5|
C=C1CC[C@@H]2[C@H](c3ccccc3)c3c(O)c(C=O)c(O)c(C=O)c3O[C@@]2(C)CC[C@H]2[C@H]1CC2(C)C
CC1(C)[C@H]2[C@H]3[C@@H](CC[C@]3(C)[C@@H](c3ccccc3)c3c(O)c(C=O)c(O)c(C=O)c3O)[C@](C)(O)CC[C@H]21
C[C@@H]1CC[C@@H]([C@@H](c2ccccc2)c2c(O)c(C=O)c(O)c(C=O)c2O)[C@]2(C)CC[C@@H](C(C)(C)O)C=C12
O=C1CN(c2c(O)cc3ccc(NCC4CC4)cc3c2F)S(=O)(=O)N1
OP(O)(=O)C(F)(F)c1cc2cc(ccc2cc1Br)C#N
COc1cc(CC(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccc(C(F)(F)P(=O)(O)O)cc2)C(=O)N[C@@H](CCCCNC(=O)c2ccc(C)c(Br)c2)C(N)=O)ccc1O
CC(C)(CCOc1ccc2cc(c(c(c2c1)F)N3CC(=O)NS3(=O)=O)O)O
O=C1CN(c2c(O)cc3c(c2F)C[C@H](NCCCC(F)F)CS3)S(=O)(=O)N1
O=C1CN(c2c(O)cc3c(c2F)C[C@H](NCCC(F)F)N3)S(=O)(=O)N1
COc1cc(/C=C2SC(=O)N(C(=O)CN3CCOCC3)C2=O)ccc1O
CS(=O)(=O)N1CCN(CC(=O)N2C(=O)S/C(=Cc3ccc([N+](=O)[O-])cc3)C2=O)CC1
O=C(CN1CCN(S(=O)(=O)c2ccccc2)CC1)N1C(=O)S/C(=Cc2ccc([N+](=O)[O-])cc2)C1=O
O=C(CN1CCn2c(nnc2C(F)(F)F)C1)N1C(=O)S/C(=Cc2ccc([N+](=O)[O-])cc2)C1=O
CS(=O)(=O)n1cc2c(n1)CN(CC(=O)N1C(=O)S/C(=Cc3ccc([N+](=O)[O-])cc3)C1=O)C2
O=C1c2ccccc2C(=O)N1CC(=O)N1C(=O)S/C(=Cc2ccc([N+](=O)[O-])cc2)C1=O
CS(=O)(=O)N1CCN(CC(=O)N2C(=O)S/C(=Cc3ccc(F)c(F)c3)C2=O)CC1
O=C(CN1CCN(S(=O)(=O)c2ccccc2)CC1)N1C(=O)S/C(=Cc2ccc(F)c(F)c2)C1=O
O=C(CN1CCn2c(nnc2C(F)(F)F)C1)N1C(=O)S/C(=Cc2ccc(F)c(F)c2)C1=O
CS(=O)(=O)n1cc2c(n1)CN(CC(=O)N1C(=O)S/C(=Cc3ccc(F)c(F)c3)C1=O)C2
O=C1c2ccccc2C(=O)N1CC(=O)N1C(=O)S/C(=Cc2ccc(F)c(F)c2)C1=O
CS(=O)(=O)N1CCN(CC(=O)N2C(=O)S/C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)CC1
O=C(CN1CCN(S(=O)(=O)c2ccccc2)CC1)N1C(=O)S/C(=Cc2ccc(OCc3ccccc3)cc2)C1=O
O=C(CN1CCn2c(nnc2C(F)(F)F)C1)N1C(=O)S/C(=Cc2ccc(OCc3ccccc3)cc2)C1=O
CS(=O)(=O)n1cc2c(n1)CN(CC(=O)N1C(=O)S/C(=Cc3ccc(OCc4ccccc4)cc3)C1=O)C2
O=C1c2ccccc2C(=O)N1CC(=O)N1C(=O)S/C(=Cc2ccc(OCc3ccccc3)cc2)C1=O
CS(=O)(=O)N1CCN(CC(=O)N2C(=O)S/C(=Cc3ccc(NC(=O)c4cc(O)c(O)c(O)c4)cc3)C2=O)CC1
O=C(Nc1ccc(/C=C2SC(=O)N(C(=O)CN3CCN(S(=O)(=O)c4ccccc4)CC3)C2=O)cc1)c1cc(O)c(O)c(O)c1
O=C(Nc1ccc(/C=C2SC(=O)N(C(=O)CN3CCn4c(nnc4C(F)(F)F)C3)C2=O)cc1)c1cc(O)c(O)c(O)c1
CS(=O)(=O)n1cc2c(n1)CN(CC(=O)N1C(=O)S/C(=Cc3ccc(NC(=O)c4cc(O)c(O)c(O)c4)cc3)C1=O)C2
O=C(Nc1ccc(/C=C2SC(=O)N(C(=O)CN3C(=O)c4ccccc4C3=O)C2=O)cc1)c1cc(O)c(O)c(O)c1
COc1ccc(-c2ccc(CN(c3ccc4oc(C(=O)O)cc4c3)S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)cc1
O=C(O)c1cc2cc(N(Cc3cccc(-c4ccccc4)c3)S(=O)(=O)c3ccc(-c4ccccc4)cc3)ccc2o1
O=C(O)c1cc2cc(N(Cc3ccc(OCc4ccccc4)cc3)S(=O)(=O)c3ccc(-c4ccccc4)cc3)ccc2o1
O=C(O)c1cc2cc(N(Cc3ccc(-c4ccccc4)cc3)S(=O)(=O)c3ccc(-c4cccc(O)c4)cc3)ccc2o1
CC(=O)C1=C(C)N=c2s/c(=C/c3ccc(OCc4ccc(C(=O)O)cc4)cc3)c(=O)n2C1c1ccc(N(C)C)cc1
Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2nn(C)cc12
CN(C)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
CCN(CC)CCCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
CN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
CCN(CC)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
C(CN1CCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
C(CN1CCCCC1)Oc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
CCCCN(C)CCOc1ccc(cc1)-c1nc2c(ccc3ccccc23)o1
OC(=O)COc1c(O)cc(cc1OCc1cccc(c1)C(F)(F)F)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1ccc(NC(=O)c2cccnc2)cc1
CC(=O)N[C@@H](Cc1ccc(c2c1cccc2)N(c3ccccc3C(=O)O)C(=O)C(=O)O)C(=O)NCCCCCOc4cc5ccccc5cc4C(=O)O
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3ccc(OCc4ccccc4)cc3)C2=O)cc1
CC(=O)OO
CC1(C)CC[C@]2(CCCCC(=O)N[C@@H](Cc3ccccc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6ccc(cc6)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:29|
CC1(C)CC[C@]2(CCCCCCCCCCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:23|
CC1(C)CC[C@]2(CCCCCCCCCCCCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:25|
CC1(C)CC[C@]2(CCCCC(=O)N[C@@H](Cc3ccccc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:29|
CC1(C)CC[C@]2(CCCCC(=O)N[C@H](Cc3ccccc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:29|
CC1(C)CC[C@]2(CCCCC(=O)N[C@@H](Cc3cnc[nH]3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:28|
CC1(C)CC[C@]2(CCCCC(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:33|
CSCC[C@H](NC(=O)CCCC[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:21|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccccc3Cl)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3cccc(Cl)c3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccc(Cl)cc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccc(F)cc3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:30|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccc(cc3)[N+]([O-])=O)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:32|
Cc1ccccc1CC(NC(=O)CCCC[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:26|
Cc1ccc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc1 |r,t:23|
COc1ccccc1CC(NC(=O)CCCC[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2)C(O)=O |r,t:27|
COc1cccc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)c1 |r,t:25|
COc1ccc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc1 |r,t:24|
CC1(C)CC[C@]2(CCCCC(=O)NC(Cc3ccc4OCOc4c3)C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:33|
COc1cccc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)c1OC |r,t:25|
COc1ccc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc1OC |r,t:24|
COc1cc(CC(NC(=O)CCCC[C@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]2(C)CC3)C(O)=O)cc(OC)c1 |r,t:23|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@@]34C)C2C1)C(O)=O |c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)c6ccccc6C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OCc6ccccc6)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1)C(O)=O |c:10|
CC1(C)CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r|
C[C@@H]1CC[C@]2(C)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@H]1C |r,c:10|
CC1(C)[C@@H](O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O |r,t:19|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
CC1(C)CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:12|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r,c:10|
CC1(C)CC[C@]2(CCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:15|
CC1(C)CC[C@]2(CCCCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:17|
CC1(C)CC[C@]2(CCCCCCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:19|
CC1(C)CC[C@]2(CCCCCCCCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:21|
OC(=O)c1cc(\C=C\c2cc(C(O)=O)c(O)c(c2)-c2ccccc2)ccc1O
OC(=O)c1cc(\C=C\c2ccccc2)ccc1O
OC(=O)c1cc(\C=C\c2ccccc2)cc(Br)c1O
OC(=O)c1cc(\C=C\c2ccccc2)cc(c1O)-c1ccccc1
OC(=O)c1ccc(\C=C\c2ccc(O)c(c2)C(O)=O)cc1O
OC(=O)c1ccc(\C=C\c2cc(Br)c(O)c(c2)C(O)=O)cc1O
COc1c(cc(\C=C\c2ccc(C(O)=O)c(O)c2)cc1-c1ccco1)C(O)=O
OC(=O)c1cc(\C=C\c2ccc(\C=C\c3ccc(O)c(c3)C(O)=O)cc2)ccc1O
OC(=O)c1cc(\C=C\c2ccc(\C=C\c3cc(Br)c(O)c(c3)C(O)=O)cc2)cc(Br)c1O
OC(=O)c1cc(\C=C\c2ccc(\C=C\c3cc(C(O)=O)c(O)c(c3)-c3ccco3)cc2)cc(-c2ccco2)c1O
COc1cc(\C=C\c2cc(Br)c(O)c(c2)C(O)=O)ccc1\C=C\c1cc(Br)c(O)c(c1)C(O)=O
COc1cc(\C=C\c2cc(C(O)=O)c(O)c(c2)-c2ccco2)ccc1\C=C\c1cc(C(O)=O)c(O)c(c1)-c1ccco1
OC(=O)c1cc(Cc2cc(C(O)=O)c(O)c(c2)-c2ccccc2)cc(c1O)-c1ccccc1
CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)C1=CC(=O)C=CC1=O |r,c:28,t:24|
COc1ccc(OC)c(c1)[C@@H]1O[C@H](Cn2cc(COC(=O)c3cccc(c3)C(=O)OCc3cn(C[C@H]4O[C@H]([C@H](OC(=O)c5ccccc5)[C@@H](OC(=O)c5ccccc5)[C@@H]4OC(=O)c4ccccc4)c4cc(OC)ccc4OC)nn3)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
O=C(OCc1cn(C[C@H]2O[C@H]([C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)C2=CC(=O)C=CC2=O)nn1)c1cccc(c1)C(=O)OCc1cn(C[C@H]2O[C@H]([C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)C2=CC(=O)C=CC2=O)nn1 |r,c:49,113,t:45,109|
O=C(OCc1cn(C[C@H]2O[C@H]([C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)C2=CC(=O)C=CC2=O)nn1)c1cccc(c1)C(=O)OCc1cn(C[C@H]2O[C@H]([C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)C2=CC(=O)C=CC2=O)nn1 |r,c:49,113,t:45,109|
COc1ccc(OC)c(c1)[C@@H]1O[C@H](Cn2cc(COC(=O)c3cccc(c3)C(=O)OCc3cn(C[C@H]4O[C@H]([C@H](OC(=O)c5ccccc5)[C@@H](OC(=O)c5ccccc5)[C@H]4OC(=O)c4ccccc4)c4cc(OC)ccc4OC)nn3)nn2)[C@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
COC1=CC(=O)C=C(C[C@@]2(C)CC[C@@]3(C)[C@@H](CCC=C3C)[C@H]2C)C1=O |r,c:18,t:2,6|
C[C@@H]1[C@@H]2CCC=C(C)[C@@]2(C)CC[C@]1(C)Cc1c(O)c(O)cc(N=CCS(O)(=O)=O)c1O |r,w:22.23,t:5|
OC(=O)c1ccc(CN2\C(S\C(=C/c3cccc(Oc4ccccc4)c3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc(Oc4ccccc4)cc3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3cccc(OCc4ccccc4)c3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc(OCc4ccccc4)cc3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3cccc4ccccc34)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc4ccccc4c3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3cccc(O)c3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc(O)cc3)C2=O)=N\c2ccccc2)cc1
COc1ccc(\C=C2/S\C(=N/c3ccccc3)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1O
COc1cc(\C=C2/S\C(=N/c3ccccc3)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1O
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc(O)c(c3)C(O)=O)C2=O)=N\c2ccccc2)cc1
COc1ccc(CCNC(=O)Cc2cccc3ccccc23)cc1
COc1ccc(CCNC(=O)Cc2ccccc2[N+]([O-])=O)cc1
COc1ccc(CCNC(=O)COc2ccccc2)cc1
Oc1ccc(cc1)-c1ccc(Cc2c(oc3cc(O)ccc3c2=O)-c2ccc(O)cc2)cc1
Oc1ccc(cc1)-c1oc2cc(O)c(O)cc2c(=O)c1Cc1ccc(cc1)-c1ccccc1
OC(=O)c1ccc(cc1O)-c1ccc(Cc2c(oc3ccccc3c2=O)-c2ccc(O)cc2)cc1
OC(=O)c1ccc(cc1O)-c1ccc(Cc2c(oc3cc(O)ccc3c2=O)-c2ccc(O)cc2)cc1
Oc1ccc(cc1)-c1oc2ccccc2c(=O)c1Cc1ccc(cc1)-c1ccc(O)c(O)c1
Oc1ccc(cc1)-c1oc2cc(O)ccc2c(=O)c1Cc1ccc(cc1)-c1ccc(O)c(O)c1
OC(=O)c1cccc(c1)-c1ccc(Cc2c(oc3cc(O)ccc3c2=O)-c2ccc(O)cc2)cc1
Oc1ccc(cc1)-c1oc2cc(O)ccc2c(=O)c1Cc1ccc(cc1)-c1ccccc1
Oc1ccc(cc1)C(=O)c1oc2ccccc2c1-c1ccc(cc1)-c1ccc(O)cc1
CSc1c(C#N)c(N)c(C#N)c(-c2ccccc2)c1-c1ccccc1
COc1ccc(cc1)-c1c(C#N)c(N)c(C#N)c(SC)c1-c1ccccc1
COc1ccc(cc1)-c1c(SC)c(C#N)c(N)c(C#N)c1-c1ccc(OC)cc1
Cc1ccc2nc(NS(=O)(=O)c3ccc(cc3)[N+]([O-])=O)sc2c1
CCOc1ccc2nc(NS(=O)(=O)c3ccc(cc3)[N+]([O-])=O)sc2c1
CC(C)C(C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C)OS(O)(=O)=O |c:7|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(CCCCc1ccoc1)OS(O)(=O)=O |t:1|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(CCc1ccccc1)OS(O)(=O)=O |t:1|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(O)CCc1ccccc1 |t:1|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CCOS(O)(=O)=O |t:1|
CC1Nc2ccccc2N1CC(CCc1ccccc1)OS(O)(=O)=O
CCCCC(C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C)OS(O)(=O)=O |c:8|
OS(=O)(=O)OC(CCc1ccccc1)COCc1cccc2ccccc12
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(Cc1ccccc1)OS(O)(=O)=O |t:1|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(CCCCc1ccccc1)OS(O)(=O)=O |t:1|
C[C@H](CCCc1ccoc1)[C@H](C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C)OS([O-])(=O)=O |c:15|
CC1=C(CC(CC(=O)c2ccccc2)C(C(O)=O)C(O)=O)[C@@]2(C)CCCC(C)(C)[C@@H]2CC1 |c:1|
CC(CCCc1ccoc1)C(C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C)OS(O)(=O)=O |c:15|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(OS(O)(=O)=O)C#C |t:1|
OS(=O)(=O)OC(CCc1ccccc1)Cc1cccc2ccccc12
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(CC=C)OS(O)(=O)=O |t:1|
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(O)CC=C |t:1|
OS(=O)(=O)OC(COc1nc2ccccc2s1)Cc1ccccc1
C[C@H]1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(CCc1ccccc1)C(C(O)=O)C(O)=O
CC1=CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1CC(O)Cc1ccccc1 |t:1|
O=Cc1coc2cc(ccc2c1=O)-c1ccc(cc1)-c1ccccc1
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCCc3cccs3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCCc3cccs3)cc2CO1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCc3cccs3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCc3cccs3)cc2CO1 |r|
CC1(C)SCC(CCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r|
CC1(C)SCC(CCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r|
CC1(C)SCC(CCCCC(=O)Nc2ccc3CO[C@@H](Cc3c2)C(O)=O)S1 |r|
CC1(C)SCC(CCCCC(=O)Nc2ccc3C[C@H](OCc3c2)C(O)=O)S1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCC3CSC(S3)(c3ccccc3)c3ccccc3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCC3CSC(S3)(c3ccccc3)c3ccccc3)cc2CO1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCCC3CCSS3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCCC3CCSS3)cc2CO1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSS3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2CO1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3SCC4NC(=O)NC34)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3SCC4NC(=O)NC34)cc2CO1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSCS3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSCS3)cc2CO1 |r|
OC(=O)[C@@H]1Cc2cc(NC(=O)CCCC[C@@H]3CCSC(S3)(c3ccccc3)c3ccccc3)ccc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSC(S3)(c3ccccc3)c3ccccc3)cc2CO1 |r|
OC(=O)[C@@H]1Cc2ccc(NC(=O)CCCC[C@@H]3CCSS3)cc2C(=O)O1 |r|
CO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
CCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
CCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
CCCCO[C@@H](Cc1ccc(NC(=O)CCCC[C@@H]2CCSS2)cc1)C(O)=O |r|
O=S(=O)(Nc1cc2nc3ccccc3nc2n1Cc1ccccc1)c1ccccc1
O=S(=O)(Nc1c(C#N)c2nc3ccccc3nc2n1Cc1ccccc1)c1ccccc1
Cc1c(C)c2OC(C)(COc3ccc(Cc4sc(=O)[nH]c4O)cc3)CCc2c(C)c1O
CN(CCOc1ccc(Cc2sc(=O)[nH]c2O)cc1)c1ccccn1
CCc1ccc(CCOc2ccc(Cc3sc(=O)[nH]c3O)cc2)nc1
OC1=NC(=O)C(S1)=Cc1cc(Br)ccc1OCc1ccccc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(Br)ccc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(Br)ccc1OCc1cccc(c1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(Br)ccc1OCc1ccccc1C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(Br)ccc1OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(Br)ccc1OCc1ccc(F)cc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(F)ccc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(F)ccc1OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(ccc1OCc1ccccc1)-c1ccccc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccccc2)cc1 |w:7.8,t:1|
FC(F)(F)c1ccc(COc2ccc(C=C3SC(=O)NC3=O)cc2)cc1 |w:14.13|
Fc1ccc(COc2ccc(C=C3SC(=O)NC3=O)cc2)cc1 |w:11.10|
Brc1cc(C=C2SC(=O)NC2=O)ccc1OCc1ccccc1 |w:4.3|
FC(F)(F)c1ccc(COc2ccc(C=C3SC(=O)NC3=O)cc2Br)cc1 |w:14.13|
Fc1ccc(COc2ccc(C=C3SC(=O)NC3=O)cc2Br)cc1 |w:11.10|
O=C1NC(=O)C(S1)=Cc1ccc(OCc2ccccc2)c(c1)-c1ccccc1 |w:7.8|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(cc2)C(F)(F)F)c(c1)-c1ccccc1 |w:7.8,t:1|
OC(=O)COc1c(Br)c(sc1C(O)=O)-c1ccc(NC(=O)CC(O)=O)cc1
CN(C)c1ccc(cc1)-c1sc(C(O)=O)c(OCC(O)=O)c1Br
OC(=O)C(=O)Nc1sc2[C@H](COC3=NS(=O)(=O)c4ccccc34)OCCc2c1C(O)=O |r,t:12|
OC(=O)COc1c(sc2c1sc1ccccc21)C(O)=O
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cnn(C(=O)c7cccnc7)c6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6c([nH]c7ccccc67)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cnn(C(=O)c7ccncc7)c6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC(=O)n1ncc2C[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C(C)(C)c12 |r,t:18|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CCCCCC(=O)n1ncc2C[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C(C)(C)c12 |r,t:22|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cnc(N)nc6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6sc(N)nc6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6nccnc6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cnn(c6C(C)(C)[C@@H]5CC[C@@]34C)-c3ccccc3)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6nc7ccccc7nc6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cn[nH]c6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cncnc6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
Cc1ncc2C[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C(C)(C)c2n1 |r,t:16|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)Cc6cnoc6C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
CNc1ncc2C[C@@]3(C)[C@@H](CC[C@]4(C)[C@@H]3CC=C3[C@@H]5CC(C)(C)CC[C@@]5(CC[C@@]43C)C(O)=O)C(C)(C)c2n1 |r,t:17|
OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccccc3F)cc2)-c2ccccc2)C1=O
OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccc(Cl)cc3)cc2)-c2ccccc2)C1=O
OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccccc3Cl)cc2)-c2ccccc2)C1=O
OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(OCc3ccccc3)cc2)-c2ccccc2)C1=O
OS(=O)(=O)CCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(cc2)S(=O)(=O)N2CCCCC2)-c2ccccc2)C1=O
Cn1c(c(-c2cn(CCC(=O)Nc3ccc(cc3)-c3ccccc3)nn2)c2cc(C(O)=O)c(O)cc12)-c1ccccc1
[K+].COc1ccc2cc(O)c(cc2c1)N1CC(=O)[N-]S1(=O)=O
OS(=O)(=O)C(F)(F)c1cccc(c1)-c1ccc(cc1)-c1ccccc1
CCc1csc(n1)[C@H](Cc1ccc(NS(O)(=O)=O)cc1)NC(=O)[C@H](CC(C)C)C(=O)OC |r|
CNC(=O)[C@@H]1Cc2ccc(NS(O)(=O)=O)cc2CN1C(=O)CCc1cccc(NS(O)(=O)=O)c1 |r|
FC(F)(F)S(=O)(=O)Nc1ccc(Oc2ccc(Oc3ccc(NS(=O)(=O)C(F)(F)F)cc3)cc2)cc1
Fc1ccc2CCN(c2c1)c1cccc(c1)-c1ccc(CN2CC(=O)NS2(=O)=O)cc1
Oc1ccc(cc1N1CC(=O)NS1(=O)=O)-c1ccc[nH]1
CS(=O)(=O)OC1C(Cl)CCCC1Cc1ccc(N2CC(=O)CS2(=O)=O)c(O)c1
Oc1cc(CC2CCCCC2)cc(F)c1N1CC(=O)CS1(=O)=O
Cc1sc(cc1C1CC(=O)NS1(=O)=O)-c1cccc(NC2CCN(CC2)S(=O)(=O)Cc2ccccc2)c1
Cc1cc(CC(NS(=O)(=O)c2cccc(F)c2)C2=NC[C@@H](CCOc3ccccc3S(C)(=O)=O)N2)ccc1C1CC(=O)NS1(=O)=O |r,t:18|
Fc1cc(C[C@H](Nc2nc3ccccc3s2)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)NS1(=O)=O |r|
Cc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1[C@@H]1CC(=O)NS1(=O)=O |r|
Cc1cc(C[C@H](NS(=O)(=O)c2ccccc2)c2nc3ccccc3[nH]2)ccc1N1CC(=O)NS1(=O)=O |r|
CCC(CC)c1ccc(cc1)N(Cc1cccc(c1)-c1ccc(COc2ccc(C[C@H](NC(C)=O)C(O)=O)cc2)cc1)C(C)C |r|
Cc1nc(sc1CCc1cccc(c1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1
OC(=O)C(=O)Nc1sc2[C@H](CNC(=O)c3cc4cc(F)ccc4[nH]3)NCCc2c1C(O)=O |r|
COC(=O)c1c(O)cccc1OCCCCNC(=O)[C@H](Cc1ccc(OCC(O)=O)c(O)c1)NC(C)=O |r|
COC(CC(C)C)c1ccc2ccc(-c3ccc(cc3)C(Cc3ccc(cc3)C(F)(F)P(O)(O)=O)(c3ccccc3)n3nnc4ccccc34)c(c2n1)P(O)(O)=O
CN(CCCCCl)P(=O)(OCc1ccc(o1)[N+]([O-])=O)C(F)(F)c1ccc(C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)Cc2ccc(cc2)C(F)(F)P(=O)(OCc2ccc(o2)[N+]([O-])=O)N(C)CCCCCl)C(=O)ON)cc1 |r|
c1cc(c(cc1\C=C\C(=O)O)O)O
CCCCCCCCCCCCCCCc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c1C(=O)Oc1cc(C)c(C(O)=O)c(O)c1 |r|
CCCCCCCCCCCCCCCc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c1C(=O)Oc1cc(C)c(C(=O)OC)c(O)c1 |r|
CCCCCCCCCCCCCCCc1cc(O)cc(O)c1C(=O)Oc1cc(C)c(C(O)=O)c(O)c1
CCCCCCCCCCCCCCCc1cc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c1C(O)=O |r|
CCOCC1(CN2CCCC2)COc2ccc3c(C)cc(=O)oc3c2C1=O
CCOCC1(CN(CC)CC)COc2ccc3c(C)cc(=O)oc3c2C1=O
Cc1cc(=O)oc2c3C(=O)C(CO)(CN4CCOCC4)COc3ccc12
Cc1cc(=O)oc2c3C(=O)C(CO)(CN4CCCCC4)COc3ccc12
Cc1cc(=O)oc2c3C(=O)C(CO)(CN4CCCC4)COc3ccc12
CCOCC1(CN2CCOCC2)COc2ccc3c(C)cc(=O)oc3c2C1=O
CCOCC1(CN2CCCCC2)COc2ccc3c(C)cc(=O)oc3c2C1=O
CCCCN(CCCC)CC1(COCC)COc2ccc3c(C)cc(=O)oc3c2C1=O
CCOCC1(CN2CCN(C)CC2)COc2ccc3c(C)cc(=O)oc3c2C1=O
CCOCC1(CN2CCN(CC2)c2ccccc2)COc2ccc3c(C)cc(=O)oc3c2C1=O
CCOCC1(CN2CCN(CC2)c2ccccn2)COc2ccc3c(C)cc(=O)oc3c2C1=O
OP(O)(=O)C(F)(F)c1ccc(cc1)C(=O)Nc1cc(c(Br)c(c1)C(F)(F)F)C(F)(F)F
CCCCCCCCCCCCCCCCCC(=O)c1n[nH]c2C(=O)N(C(=O)c12)c1ccccc1
CCCCCCCCCCCCCCCCCC(=O)c1cc([nH]n1)C(=O)Nc1ccccc1C(=O)OC
CCCCCCCCCCCCCCCCCC(=O)c1cc([nH]n1)C(=O)Nc1ccsc1C(=O)OC
CCCCCCCCCCCCCCCCCC(=O)c1cc([nH]n1)C(=O)Nc1ccccc1C(O)=O
CCCCCCCCCCCCCCCCCC(=O)c1cc([nH]n1)C(=O)Nc1ccsc1C(O)=O
CC1(C)CC(=O)C2C(C=C(N=C2C1)c1ccccc1)c1ccc(cc1)[N+]([O-])=O |c:8,10|
CC1(C)CC(=O)C2C(C=C(N=C2C1)c1ccccc1)c1ccc(Cl)cc1 |c:8,10|
CC1(C)CC(=O)C2C(C=C(N=C2C1)c1ccccc1)c1ccc(F)cc1 |c:8,10|
COc1ccc(cc1)C1C=C(N=C2CC(C)(C)CC(=O)C12)c1ccccc1 |c:10,t:12|
Fc1ccc(cc1)C1C=C(N=C2CCCC(=O)C12)c1ccccc1 |c:9,t:11|
Cc1ccc(cc1)C1=CC(C2C(=O)CC(C)(C)CC2=N1)c1ccccc1 |c:20,t:8|
CC1(C)CC(=O)C2C(C=C(N=C2C1)c1ccccc1)c1ccco1 |c:8,10|
CCOC(=O)C1=CC(C2C(=O)CC(C)(C)CC2=N1)c1ccc(F)cc1 |c:17,t:5|
CCOC(=O)C1=CC(C2C(=O)CC(C)(C)CC2=N1)c1ccc(Br)cc1 |c:17,t:5|
[#6]\[#6](-[#6])=[#6]\[#6@H]-1-[#6][C@@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@@H](-[#8])-[#6]-[#6][C@]23[#6])[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6](=O)-[#6]-[#6][C@]23[#6])[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#6](-[#6])=O)[#6](=O)-[#8]1 |r|
[#6]-[#6]-[#6](=O)-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-[#6][C@@]3([#6])[#6@@H]-4-[#6]-[#6]-[#6@@H](-[#6@H]-4-[#6]-[#6]-[#6@H]23)[C@@]2([#8])[#6]-[#6@H](-[#8]-[#6]2=O)\[#6]=[#6](\[#6])-[#6])C1([#6])[#6] |r|
[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-[#6][C@@]3([#6])[#6@@H]-4-[#6]-[#6]-[#6@@H](-[#6@H]-4-[#6]-[#6]-[#6@H]23)[C@@]2([#8])[#6]-[#6@H](-[#8]-[#6]2=O)\[#6]=[#6](\[#6])-[#6])C1([#6])[#6] |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#6](=O)-c2ccccc2)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2ccccn2)[#6](=O)-[#8]1 |r|
[#6]-[#8]-c1ccccc1-[#6](=O)-[#8]-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-[#6][C@@]3([#6])[#6@@H]-4-[#6]-[#6]-[#6@@H](-[#6@H]-4-[#6]-[#6]-[#6@H]23)[C@@]2([#8])[#6]-[#6@H](-[#8]-[#6]2=O)\[#6]=[#6](\[#6])-[#6])C1([#6])[#6] |r|
[#6]-[#8]-c1cccc(c1)-[#6](=O)-[#8]-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-[#6][C@@]3([#6])[#6@@H]-4-[#6]-[#6]-[#6@@H](-[#6@H]-4-[#6]-[#6]-[#6@H]23)[C@@]2([#8])[#6]-[#6@H](-[#8]-[#6]2=O)\[#6]=[#6](\[#6])-[#6])C1([#6])[#6] |r|
[#6]-[#8]-c1ccc(cc1)-[#6](=O)-[#8]-[#6@H]1-[#6]-[#6][C@@]2([#6])[#6@@H](-[#6]-[#6][C@@]3([#6])[#6@@H]-4-[#6]-[#6]-[#6@@H](-[#6@H]-4-[#6]-[#6]-[#6@H]23)[C@@]2([#8])[#6]-[#6@H](-[#8]-[#6]2=O)\[#6]=[#6](\[#6])-[#6])C1([#6])[#6] |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2ccccc2-[#7+](-[#8-])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2cccc(c2)-[#7+](-[#8-])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2ccc(cc2)-[#7+](-[#8-])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2ccc(cc2-[#7+](-[#8-])=O)-[#7+](-[#8-])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2cccc(c2)-[#6](-[#8])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2ccc(cc2)-[#6](-[#8])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@H](-[#6]-[#6][C@]23[#6])-[#8]-[#6](=O)-c2ccc(-[#6](-[#8])=O)c(c2)-[#7+](-[#8-])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6](-[#6]-[#6][C@]23[#6])-[#7]-[#6]-c2cc(F)cc(F)c2)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6](-[#6]-[#6][C@]23[#6])-[#7]-[#6]-c2ccc(cc2)-[#7+](-[#8-])=O)[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6]-[#6@@H]3-[#6@@H]-2-[#6]-[#6]-[#6@H]2[C@@]3([#6])[#6]-[#6]-[#6@H]3C([#6])([#6])[#6@@H](-[#8])-[#6]-[#6][C@]23[#6])[#6](=O)-[#8]1 |r|
Oc1cc(cc(O)c1O)C(=O)OC[C@H]1O[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H](OC(=O)c2cc(O)c(O)c(O)c2)[C@@H]1OC(=O)c1cc(O)c(O)c(O)c1 |r|
Cc1ccc(cc1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
OC(=O)c1cccc2c3cc(ccc3oc12)-c1csc(n1)-c1ccc(cc1)[N+]([O-])=O
Nc1ccc(cc1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
CN(C)c1ccc(cc1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
OC(=O)c1cccc2c3cc(ccc3oc12)-c1csc(n1)-c1ccc(cc1)N1CCCC1
OC(=O)c1cccc2c3cc(ccc3oc12)-c1csc(n1)-c1ccc(cc1)N1CCCCC1
OC(=O)c1cccc2c3cc(ccc3oc12)-c1csc(n1)-c1ccc(cc1)N1CCOCC1
CC1CN(CC(C)O1)c1ccc(cc1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
OC(=O)c1ccc(cc1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
OC(=O)[C@@H](Cc1ccccc1)C(=O)c1c(Br)cc(cc1Br)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O |r|
OC(=O)c1cccc2c3cc(ccc3oc12)-c1csc(n1)-c1ccc(I)cc1
OC(=O)c1cccc2c3cc(ccc3oc12)-c1csc(n1)-c1cccc(I)c1
OC(=O)\C=C\c1ccc(cc1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
OC(=O)\C=C\c1cccc(c1)-c1nc(cs1)-c1ccc2oc3c(cccc3c2c1)C(O)=O
CCc1cc(C[C@H]2NC(=O)CN(CCCCOc3cccc(O)c3C(=O)OC)C2=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
Cc1nc(sc1OCCc1cc(ccc1OCc1ccccc1)C(O)(C(O)=O)C(F)(F)F)-c1ccc(Cl)cc1
OC(=O)C(=O)c1ccc(OCc2ccc(COc3ccc(cc3)C(=O)C(O)=O)c(c2)C(=O)Nc2ccc(Oc3ccc(cc3)-c3ccccc3)cc2)cc1
OC(=O)C(=O)c1ccc(OCc2ccc(COc3ccc(cc3)C(=O)C(O)=O)c(c2)C(=O)Nc2ccc(Oc3ccc(SC(F)(F)F)cc3)cc2)cc1
CCc1ccc(Oc2ccc(NC(=O)c3cc(COc4ccc(cc4)C(=O)C(O)=O)ccc3COc3ccc(cc3)C(=O)C(O)=O)cc2)cc1
CCCCCCc1ccc(Oc2ccc(NC(=O)c3cc(COc4ccc(cc4)C(=O)C(O)=O)ccc3COc3ccc(cc3)C(=O)C(O)=O)cc2)cc1
CC1(C)CC[C@]2(COC(=O)CC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:18|
CC1(C)CC[C@]2(COC(=O)CCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:19|
CC1(C)CC[C@]2(COC(=O)CCCC(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:20|
CC1(C)CC[C@]2(COC(=O)c3ccccc3C(O)=O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:24|
C[C@]12CC[C@H]3[C@@H](CCc4cc(OC(=O)N(CCCl)CCCl)ccc34)[C@@H]1CC[C@@H]2OP(O)(O)=O |r|
C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2OP(O)(O)=O |r|
COc1ccc(cc1)-c1oc2cc(O)c(cc2c1-c1cn(CCCC(=O)Nc2cccc3ccccc23)nn1)C(O)=O
Cc1ccc(cc1)-c1oc2cc(O)c(cc2c1-c1cn(CCCC(=O)Nc2ccc(Cl)c3ccccc23)nn1)C(O)=O
Cc1ccc(cc1)-c1oc2cc(O)c(cc2c1-c1cn(CCCC(=O)Nc2cccc3ccccc23)nn1)C(O)=O
COc1ccc2nc(NC(=O)CCCn3cc(nn3)-c3c(oc4cc(O)c(cc34)C(O)=O)-c3cccc(C)c3)sc2c1
COC(=O)c1cc2c(-c3cn(CCCC(=O)Nc4ccc(Cl)c5ccccc45)nn3)c(oc2cc1O)-c1ccccc1
OC[C@@H](C(O)=O)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
C[C@@H](O)[C@@H](CO)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
OC[C@@H](C(O)=O)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
C[C@@H](O)[C@@H](C(O)=O)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
OC(=O)[C@H](Cc1ccccc1)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
OC(=O)[C@H](Cc1ccc(O)cc1)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
OC(=O)[C@H](Cc1ccccc1)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
OC(=O)[C@H](Cc1ccc(O)cc1)n1cc(CO[C@@H]2O[C@H](COCc3ccccc3)[C@H](OCc3ccccc3)[C@H](OCc3ccccc3)[C@H]2OCc2ccccc2)nn1 |r|
COC(=O)[C@H](Cc1ccc(O)cc1)n1cc(CNC(=O)c2ccccc2)nn1 |r|
OC(=O)[C@H](Cc1ccc(O)cc1)n1cc(CNC(=O)c2ccccc2)nn1 |r|
Cc1ccc(C)n1-c1ccc(O)cc1C(O)=O |(5.57,-.15,;4.1,-.62,;3.62,-2.09,;2.08,-2.09,;1.61,-.62,;.14,-.15,;2.86,.28,;2.85,1.82,;1.51,2.59,;1.51,4.14,;2.84,4.91,;2.84,6.45,;4.18,4.14,;4.18,2.59,;5.66,2.2,;6.75,3.29,;6.06,.71,)|
CCCCCCCCCCCCCCC(=O)N[C@@H](C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(N)=O)c1ccc(cc1)C(F)(F)P(O)(O)=O |r|
CN(CCCCCl)P(=O)(OCc1ccc(o1)[N+]([O-])=O)C(F)(F)c1ccc(C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)Cc2ccc(cc2)C(F)(F)P(=O)(OCc2cc(co2)[N+]([O-])=O)N(C)CCCCCl)C(N)=O)cc1 |r|
c1ccc(cc1)C(=O)CC(=O)C(=O)O
OC(=O)C(=O)CC(=O)c1ccccc1F
OC(=O)C(=O)CC(=O)c1ccc(cc1)C(F)(F)F
OC(=O)C(=O)CC(=O)c1cccc(OCc2ccccc2)c1
c1ccc(cc1)CN(Cc2ccccc2)c3cccc(c3)C(=O)CC(=O)C(=O)O
OC(=O)C(=O)CC(=O)c1cccc(Cc2ccccc2F)c1
OC(=O)c1ccc(COc2cccc(\C=C3/S\C(=N/c4ccccc4)N(Cc4ccc(cc4)C(O)=O)C3=O)c2)cc1
CCCC(CCC)c1ccc(OCc2ccc(cc2)-c2csc(CN(CC(O)=O)Cc3ncc(s3)C(C)(C)C)n2)cc1
OC(=O)c1ccc(\C=N\OCc2ccc(cc2)-c2cccc(c2)C(F)(F)P(O)(O)=O)o1
[#6]-[#8]-c1ccc(cc1-[#6]\[#6]=[#6](/[#6])-[#6])-[#6](=O)\[#6]=[#6]\c1cc(Br)c(-[#8])cc1-[#8]-[#6]
COc1ccc(cc1CC=C)C(=O)\C=C\c1cc(Br)c(O)cc1OC
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(O)c(c1)C(C)C(C)=C
[#6]-[#8]-c1cc(-[#8])c(Br)cc1\[#6]=[#6]\[#6](=O)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(O)c(CC=C)c1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(NC(=O)c2ccc(cc2)C(C)(C)C)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1cccc(NS(C)(=O)=O)c1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(cc1)N1CCOCC1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(cc1)-n1cccn1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1cccc(c1)N1CCCCC1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccccc1N1CCCCC1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(cc1)N1CCCCC1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1cccc(c1)N(CC=C)CC=C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccccc1N(CC=C)CC=C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(cc1)N(CC=C)CC=C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1cc2OCOc2cc1N(C)C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1cccc(c1)N(C)C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccccc1N(C)C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(cc1)N(C)C
COc1cc(O)c(Br)cc1\C=C\C(=O)c1cccc(N)c1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(N)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OS(C)(=O)=O)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OS(=O)(=O)c2ccc(C)cc2)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OC(=O)c2ccc(cc2)C(C)(C)C)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OC(=O)c2ccc(Br)cc2)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OC(=O)c2ccccc2)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OCCCC(O)=O)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OCC(O)=O)cc1
CCOC(=O)CCCOc1ccc(cc1)C(=O)\C=C\c1cc(Br)c(O)cc1OC
CCOC(=O)COc1ccc(cc1)C(=O)\C=C\c1cc(Br)c(O)cc1OC
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OCc2ccccc2)cc1
[#6]-[#8]-c1cc(-[#8])c(Br)cc1\[#6]=[#6]\[#6](=O)-c1ccc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])cc1
CCCCOc1ccc(cc1)C(=O)\C=C\c1cc(Br)c(O)cc1OC
COc1cccc(c1)C(=O)\C=C\c1cc(Br)c(O)cc1OC
COc1ccc(cc1)C(=O)\C=C\c1cc(Br)c(O)cc1OC
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(O)cc1
COc1cc(O)c(Br)cc1\C=C\C(=O)c1ccc(OC)c(c1)C(C)C(C)=C
[#6]-[#8]-c1cc(-[#8])c(Br)cc1\[#6]=[#6]\[#6](=O)-c1ccc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(c1)-[#6](-[#6])-[#6](-[#6])=[#6]
COc1ccc(cc1C(C)C(C)=C)C(=O)\C=C\c1cc(Br)c(O)cc1O
COc1cc(OC2CCCCO2)c(Br)cc1\C=C\C(=O)c1ccc(O)c(c1)C(C)C(C)=C
COc1ccc(cc1C(C)C(C)=C)C(=O)\C=C\c1cc(Br)c(OC2CCCCO2)cc1O
[#6]-[#8]-[#6@H]-1-[#8]-[#6@H](-[#6]-[#6]=[#6]-1-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@@H]-1-[#6]-[#6](=O)-[#7]-[#6]-1=O |r,c:6|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6]-1=[#6]-[#6]-[#6@@H](-[#8]-[#6@@H]-1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-[#7]-[#6]-1=O |r,t:16|
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCN(C)C)c1
CCN(CC)CCOc1cc(OC)ccc1-c1cc(no1)-c1ccccc1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCN(C(C)C)C(C)C)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCN2CCCC2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCN2CCOCC2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCCCl)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCN2CCCCC2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCCN(C)C)c1
CCN(CC)CCCOc1cc(OC)ccc1-c1cc(no1)-c1ccccc1
CCCCN(C)CCCOc1cc(OC)ccc1-c1cc(no1)-c1ccccc1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCCN2CCCCC2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCCN2CCCC2)c1
CCOC(=O)COc1cc(OC)ccc1-c1cc(no1)-c1ccccc1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCC(O)=O)c1
CCOC(=O)CCCOc1cc(OC)ccc1-c1cc(no1)-c1ccccc1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCCCC(O)=O)c1
CCN(CC)CC(O)COc1cc(OC)ccc1-c1cc(no1)-c1ccccc1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCC2CO2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCC(O)CN2CCCC2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(OCC(O)CN2CCCCC2)c1
COc1ccc(-c2cc(no2)-c2ccccc2)c(O)c1
CO[C@H]1O[C@H](Cn2cc(COC[C@H](NC(=O)OC(C)(C)C)C(O)=O)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r|
CO[C@H]1O[C@H](Cn2cc(CO[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(O)=O)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r|
CO[C@H]1O[C@H](Cn2cc(COC[C@H](NC(=O)OC(C)(C)C)C(O)=O)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r|
CO[C@H]1O[C@H](Cn2cc(CO[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(O)=O)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |r|
CC(C)(C)OC(=O)N[C@@H](COCc1cn(nn1)[C@@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)C(O)=O |r|
C[C@H](OCc1cn(nn1)[C@@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(O)=O |r|
CC(C)(C)OC(=O)N[C@@H](COCc1cn(nn1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(O)=O |r|
CO[C@H]1O[C@H](Cn2cc(COC[C@H](NC(=O)OC(C)(C)C)C(O)=O)nn2)[C@@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 |r|
CO[C@H]1O[C@H](Cn2cc(CO[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(O)=O)nn2)[C@H](OCc2ccccc2)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r|
CCCCOc1ccc(cc1)-c1ccc(Cn2ccc3c2C(=O)NCCC3=O)cc1
COc1ccc(cc1)-c1ccc(Cn2ccc3c2C(=O)NCCC3=NNc2ccccn2)cc1 |w:24.27|
COc1ccc(cc1)-c1ccc(Cn2c3c(C(=O)CCNC3=O)c3ccccc23)cc1
CC(=O)N(c1ccc2oc3CCCCc3c2c1)S(=O)(=O)c1ccc(cc1)C(O)=O
CC(=O)c1c(C)oc2ccc(NS(=O)(=O)c3cccc(c3)C(O)=O)cc12
Cc1cc(c(cc1-n1[nH]c(cc1=O)C(O)=O)S(O)(=O)=O)S(O)(=O)=O
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccccc2)cc1OCc1ccccc1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(cc2)C(F)(F)F)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(F)cc2)cc1OCc1ccc(F)cc1 |w:7.8,t:1|
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(C=C2SC(O)=NC2=O)c(OS(=O)(=O)c2ccc(C)cc2)c1 |w:15.15,c:20|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccccc2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
Fc1ccc(COc2cc(OCc3ccccc3)ccc2C=C2SC(=O)NC2=O)cc1 |w:21.22|
Fc1ccc(COc2ccc(C=C3SC(=O)NC3=O)c(OCc3ccccc3)c2)cc1 |w:11.10|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(F)cc2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC(=O)COc1cc(OCc2ccccc2)ccc1C=C1SC(O)=NC1=O |w:19.20,c:25|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(cc2)S(=O)(=O)N2CCOCC2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccccn2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2cccnc2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(C=C2SC(O)=NC2=O)c(OCc2ccc(cc2)C(F)(F)F)c1 |w:15.15,c:20|
OC1=NC(=O)C(S1)=Cc1ccc(OS(=O)(=O)c2ccc(Br)cc2)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
CC(=O)Nc1ccc(COc2cc(OS(=O)(=O)c3ccc(C)cc3)ccc2C=C2SC(O)=NC2=O)cc1 |w:27.28,c:33|
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(C=C2SC(=O)NC2=O)c(OCc2ccc(NC(=O)c3cccc(c3)C(F)(F)F)cc2)c1 |w:15.15|
OC1=NC(=O)C(S1)=Cc1ccc(OS(=O)(=O)c2ccc(Br)cc2)cc1OCc1ccc(cc1)S(=O)(=O)N1CCOCC1 |w:7.8,t:1|
OC1=NC(=O)C(S1)=Cc1cc(Br)c(OCc2ccc(cc2)C(F)(F)F)cc1OCc1ccc(cc1)C(F)(F)F |w:7.8,t:1|
Cc1ccc(cc1)S(=O)(=O)Oc1cc(OCc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c(C=C2SC(O)=NC2=O)cc1Br |w:31.32,c:37|
Cc1ccc(cc1)S(=O)(=O)Oc1cc(OCc2ccc(cc2)C(F)(F)F)c(C=C2SC(O)=NC2=O)cc1Br |w:27.28,c:33|
[#6]-[#8]-c1cc(-[#8]-[#6])c(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@H]-1-[#6]-[#8]-c2cc(-[#8])ccc2-[#6]-1=O |r|
[#6]-[#8]-c1cc(cc(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc2-[#6]=[#6]C([#6])([#6])[#8]-c12)-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1 |r,c:10|
[#6]-[#8]-c1ccc(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
Oc1ccc2C(=O)C[C@H](Oc2c1)c1ccc(O)c(C=O)c1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-[#6]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1
[#6]-[#8]-c1cc(-[#8])c(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-1-[#6]-[#8]-c2cc(-[#8])ccc2-[#6]-1=O
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc2-[#6]-[#6](-[#8])C([#6])([#6])[#8]-c12)-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1 |r|
Oc1ccc(cc1)[C@@H]1CC(=O)c2ccc(O)cc2O1 |r|
COc1cc(ccc1O)[C@@H]1CC(=O)c2ccc(O)cc2O1 |r|
CC1(C)Oc2ccc(cc2CC1O)[C@@H]1CC(=O)c2ccc(O)cc2O1 |r|
[#6]-[#8]-c1cc(-[#8])c(cc1-[#6]\[#6]=[#6](\[#6])-[#6])[C@]1([#8])[#6]-[#8]-c2cc(-[#8])ccc2-[#6]1=O |r|
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)COc1ccc(Cl)cc1
NC(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)C(O)=O
CC(C)(C)OC(=O)NC(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)C(O)=O
OC(=O)C(Cc1ccc2cc(OCc3ccc(Cl)cc3)ccc2c1)NC(=O)c1ccccc1
COc1ccc(COc2ccc3cc(CC(NC(=O)c4ccccc4)C(O)=O)ccc3c2)cc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)c1ccccc1
OC(=O)C(Cc1ccc2cc(O)ccc2c1)NC(=O)c1ccccc1
CC(C)(C)OC(=O)NC(Cc1ccc2cc(O)ccc2c1)C(O)=O
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)Cc1ccc(Cl)cc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)CCc1ccccc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccccc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccccc1F
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1cccc(F)c1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccc(F)cc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccccc1Cl
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1cccc(Cl)c1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccc(Cl)cc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccccc1Br
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccc(Br)cc1
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccc(Cl)cc1Cl
OC(=O)C(Cc1ccc2cc(OCc3ccccc3F)ccc2c1)NC(=O)\C=C\c1ccc(Cl)c(Cl)c1
COc1cccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)c1
COc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1
COc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1OC
Cc1ccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)cc1
c1cc(cc(c1)O)C(=O)O
c1cc(c(cc1O)C(=O)O)O
c1c(cc(cc1O)O)C(=O)O
CO[C@H]1O[C@H](COCc2cn(CCCOc3cccc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCCOc3cccc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCCCOc3cccc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCOc3cc(O)cc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCCOc3cc(O)cc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
CO[C@H]1O[C@H](COCc2cn(CCCCCOc3cc(O)cc(c3)C(O)=O)nn2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
OC(=O)c1sccc1SCc1ccc(Br)c(Br)c1
OC(=O)c1sccc1SCc1cccc(Cl)c1Cl
c1cc(cc(c1)S(=O)(=O)NC(=O)c2c(ccs2)SCc3ccc(c(c3)Cl)Cl)N
Cc1ccc(CSc2ccsc2C(O)=O)cc1C
OC(=O)c1sccc1SCc1ccccc1
Clc1ccc(CSc2ccsc2C(=O)NS(=O)(=O)c2ccccc2)cc1Cl
OC(=O)c1sccc1SCc1ccc2ccccc2c1
COc1ccc(cc1C(=O)O)S(=O)(=O)NC(=O)c2c(ccs2)SCc3ccc(c(c3)Cl)Cl
OC(=O)c1sccc1SCc1ccc(Cl)cc1
OC(=O)c1sccc1NCc1ccc(Cl)c(Cl)c1
OC(=O)c1sccc1SCc1cccc(Cl)c1
c1ccc(c(c1)C(=O)O)SCc2ccc(c(c2)Cl)Cl
c1cc(c(cc1CSc2cc(ccc2C(=O)O)C#CCCO)Cl)Cl
OC(=O)c1sccc1S(=O)(=O)Cc1ccc(Cl)c(Cl)c1
Nc1cccc(c1)C#Cc1ccc(C(O)=O)c(SCc2ccc(Cl)c(Cl)c2)c1
CS(=O)(=O)NC(=O)c1c(ccs1)SCc2ccc(c(c2)Cl)Cl
NCC(=O)Nc1cccc(c1)C#Cc1ccc(C(O)=O)c(SCc2ccc(Cl)c(Cl)c2)c1
c1cc(c(cc1CSc2ccsc2C(=O)O)Cl)Cl
OC(=O)c1ccc(Br)cc1SCc1ccc(Cl)c(Cl)c1
COC(=O)c1cc(ccc1OC)S(=O)(=O)NC(=O)c1sccc1SCc1ccc(Cl)c(Cl)c1
OC(=O)c1sccc1OCc1ccc(Cl)c(Cl)c1
CS(=O)(=O)NC(=O)c1ccccc1SCc1ccc(Cl)c(Cl)c1
OC(=O)c1ccc(cc1SCc1ccc(Cl)c(Cl)c1)C#Cc1cccc(Cl)c1
CC1(C)C[C@]2(O)O[C@@H]3C[C@@]4(C)[C@@H]5CC=C6[C@@H](C=C(O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)C(=O)C6(C)C)[C@]5(C)C(=O)C[C@]4(C)[C@H]3[C@@](C)(O)[C@]2(O)O1 |r,c:13,t:16|
CC(C)(O)[C@@H]1CC(=O)[C@](C)(O)[C@H]2[C@@H](C[C@@]3(C)[C@@H]4CC=C5[C@@H](C=C(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(=O)C5(C)C)[C@]4(C)C(=O)C[C@]23C)O1 |r,c:18,t:21|
C[C@@](O)([C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC=C4[C@@H](C=C(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C)C(=O)C[C@H]1NC(=O)OC1(C)C |r,c:11,t:14|
CC(C)CC\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\c2cccs2)C(O)=O)c(C)o1 |r|
CC(C)CC\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\c2ccco2)C(O)=O)c(C)o1 |r|
CCOCCC(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CCO\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CCOC\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CCC(O)\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CC(C)CC\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C=C\CO)C(O)=O)c(C)o1 |r|
CC(C)CC\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C2CC2)C(O)=O)c(C)o1 |r|
CC(C)CC\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)CCC=C)C(O)=O)c(C)o1 |r|
CC(C)CC\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)CCCC=C)C(O)=O)c(C)o1 |r|
CCCCCC(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CCC\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
C\C=C\C=C(/C)C(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
[#6]-[#6](-[#6])-[#6]-[#6]\[#6]=[#6]\c1nc(-[#6]-[#6]-[#8]-c2ccc3-[#6]-[#6@H](-[#7](-[#6]-c3c2)-[#6](=O)\[#6]=[#6]\[#6]=[#6](\[#6])-[#6])-[#6](-[#8])=O)c(-[#6])o1 |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(CCCCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(oc3C)C(\C)=C\CCC(C)C)ccc2C[C@H]1C(O)=O |r|
CCCC(C)\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C=C\C)C(O)=O)c(C)o1 |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CCC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CCC(CC)\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C=C\C)C(O)=O)c(C)o1 |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CC(C)(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CCC(C)(C)\C=C\c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C=C\C)C(O)=O)c(C)o1 |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\CC(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\C(C)(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
C\C=C\C=C\C(=O)N1Cc2cc(OCCc3nc(\C=C\C(C)C)oc3C)ccc2C[C@H]1C(O)=O |r|
CC\C=C(/C)c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C=C\C)C(O)=O)c(C)o1 |r|
CC\C(=C/C)c1nc(CCOc2ccc3C[C@H](N(Cc3c2)C(=O)\C=C\C=C\C)C(O)=O)c(C)o1 |r|
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(Br)c(c1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(c(F)c1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(F)c(c1)C(F)(F)P(O)(O)=O
NS(=O)(=O)C(F)(F)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1Br
NS(=O)(=O)C(F)(F)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1F
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C1CC(=O)NS1(=O)=O)Cc1ccc(cc1)-c1csnn1
Cc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)ccc1C1CC(=O)NS1(=O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(C2CC(=O)NS2(=O)=O)c(Br)c1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(C2CC(=O)NS2(=O)=O)c(F)c1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc2cc(Br)c(cc2c1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc2cc(Br)c(cc2n1)C(F)(F)P(O)(O)=O
NS(=O)(=O)C(F)(F)c1cc2cc(CN(Cc3ccc(cc3)-c3csnn3)S(=O)(=O)c3ccc(OCC(O)=O)cc3)ccc2cc1Br
NS(=O)(=O)C(F)(F)c1cc2nc(CN(Cc3ccc(cc3)-c3csnn3)S(=O)(=O)c3ccc(OCC(O)=O)cc3)ccc2cc1Br
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc2cc(F)c(cc2c1)C(F)(F)P(O)(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc2cc(F)c(cc2n1)C(F)(F)P(O)(O)=O
NS(=O)(=O)C(F)(F)c1cc2cc(CN(Cc3ccc(cc3)-c3csnn3)S(=O)(=O)c3ccc(OCC(O)=O)cc3)ccc2cc1F
NS(=O)(=O)C(F)(F)c1cc2nc(CN(Cc3ccc(cc3)-c3csnn3)S(=O)(=O)c3ccc(OCC(O)=O)cc3)ccc2cc1F
[O-][N+](=O)c1ccc(cc1)C(=O)\C=C\c1ccc2OCOc2c1
Brc1ccc(cc1)C(=O)\C=C\c1ccc2ccccc2c1
Clc1ccc(s1)C(=O)\C=C\c1ccc2ccccc2c1
c1cc(cc(c1)[N+](=O)[O-])C(=O)/C=C/c2ccc3c(c2)OCO3
OC(=O)c1ccc(\C=C\C(=O)c2ccc3ccccc3c2)cc1
COc1ccc(C(=O)\C=C\c2ccc(OCc3ccccc3)c(OC)c2)c(OC)c1
CCOP(=O)(OCC)[C@H](Nc1ccc(Cl)cc1)c1ccccc1O |r|
CCOP(=O)(OCC)[C@H](Nc1ccc(Br)cc1)c1ccccc1O |r|
CCOP(=O)(OCC)[C@H](Nc1ccc(cc1)[N+]([O-])=O)c1ccccc1O |r|
CCOP(=O)(OCC)[C@H](Nc1ccccc1Cl)c1ccccc1O |r|
Oc1ccc(N[C@H](c2ccccc2O)P(O)(O)=O)cc1 |r|
CCOP(O)(=O)C(N[C@@H](CO)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(N[C@@H](Cc1cnc[nH]1)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(N[C@@H](Cc1c[nH]c2ccccc12)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(N[C@@H](CS)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(N[C@@H](Cc1ccccc1)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(N[C@@H](Cc1ccc(O)cc1)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(NCCCCCCNC(c1ccccc1O)P(O)(=O)OCC)c1ccccc1O
CCOP(O)(=O)C(NCCCNC(c1ccccc1O)P(O)(=O)OCC)c1ccccc1O
CCOP(O)(=O)C(NCCNC(c1ccccc1O)P(O)(=O)OCC)c1ccccc1O
CCOP(O)(=O)C(NCC([O-])=O)c1ccccc1O
CCOP(O)(=O)C(N[C@@H](C)C([O-])=O)c1ccccc1O |r|
CCOP(O)(=O)C(N[C@@H]([C@@H](C)O)C([O-])=O)c1ccccc1O |r|
CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](C)[C@@H](NC(=O)\C(=C\C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(O)=O)C(O)=O)C(C)C
CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(O)=O)C(O)=O
COC[C@@H]([C@H](O)[C@H](O)C(=O)NCC[C@H](C)c1nc(\C=C\C[C@@H]2O[C@]3(C[C@@H](O)[C@@H]2C)O[C@H]([C@H](C[C@H](O)[C@H](C)[C@H](O)[C@H](C)\C=C(/C)\C(\C)=C\C=C\C(\C)=C/C#N)OC)[C@H](OP(O)(O)=O)C3(C)C)co1)N(C)C |r|
C[C@@H](C[C@H](O)[C@H]1O[C@@H]2CC[C@@]3(CC[C@@H](O3)\C=C\[C@@H](C)[C@@H]3CC(C)=C[C@@]4(O[C@H](C[C@@](C)(O)C(O)=O)CC[C@H]4O)O3)O[C@H]2[C@H](O)C1=C)[C@H]1O[C@@]2(CCCCO2)CC[C@H]1C |r,c:23|
[O-]P([O-])(=O)C(F)(F)c1cccc2ccccc12
OP(O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)P(O)([O-])=O
OP(O)(=O)C(F)(F)c1ccc2cccc(c2c1)C(F)(F)P(O)([O-])=O
[O-]P([O-])(=O)C(F)c1ccc2ccc(cc2c1)C(F)P([O-])([O-])=O
[O-]P([O-])(=O)Cc1ccc2ccc(CP([O-])([O-])=O)cc2c1
OP(O)(=O)C(F)(F)c1ccc2cc(ccc2c1)C(F)(F)P(O)([O-])=O
Oc1cc(cc2ccccc12)C(F)(F)P([O-])([O-])=O
OC(=O)Cc1ccc(OCP([O-])([O-])=O)cc1
Oc1ccc(Cc2ccc(OCP([O-])([O-])=O)cc2)cc1
OP([O-])(=O)COc1cccc2c1ccc1ccccc21
[O-]P([O-])(=O)COc1ccccc1
OP([O-])(=O)COc1cccc2ccccc12
OP([O-])(=O)COc1ccc2ccccc2c1
CCOC(=O)C1[C@H]2CC[C@H](O2)C1C(O)=O
COC(=O)C1[C@H]2CC[C@H](O2)C1C(O)=O
CCCOC(=O)C1[C@H]2CC[C@H](O2)C1C(O)=O
C[C@]12[C@@H]3CC[C@@H](O3)[C@@]1(C)C(=O)OC2=O
[O-]P([O-])(=O)C(F)(F)c1cccc(\C=C/C(=O)OCC=C)c1
[O-]P([O-])(=O)C(F)(F)c1cccc(c1)-c1ccccc1
Cc1c(C(O)=O)c(O)cc2C(=O)c3c(O)c(O)c([C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)c(O)c3C(=O)c12
CC(C)C=CC(=O)c1cc(O)c2c(O)ccc(O)c2c1O |w:4.4|
Oc1cc(c2ccccc2c1N=Nc1c(O)c(cc2cc(cc(c12)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O)S([O-])(=O)=O |w:11.12|
Oc1ccc(cc1C([O-])=O)N=Nc1ccc(cc1)[N+]([O-])=O |w:10.10|
c1ccc2c(c1)cc(c(c2Cc3c4ccccc4cc(c3O)C(=O)O)O)C(=O)O
OC(=O)c1ccccc1-c1c2ccc(O)cc2oc2cc(=O)ccc12 |(-6.39,-28.75,;-5.64,-30.09,;-6.42,-31.42,;-4.1,-30.1,;-4.09,-28.56,;-2.74,-27.79,;-1.41,-28.57,;-1.42,-30.11,;-2.76,-30.87,;-2.77,-32.41,;-1.43,-33.19,;-.1,-32.42,;1.23,-33.2,;1.22,-34.74,;2.54,-35.52,;-.12,-35.5,;-1.44,-34.73,;-2.78,-35.49,;-4.11,-34.72,;-5.43,-35.48,;-6.76,-34.72,;-8.09,-35.49,;-6.76,-33.18,;-5.43,-32.4,;-4.1,-33.18,)|
Oc1c(O)c2C(=O)c3ccccc3C(=O)c2cc1S([O-])(=O)=O
Cc1[nH]n(-c2ccccc2)c(=O)c1N=Nc1c(O)cc(c2ccccc12)S(O)(=O)=O
Cc1cc(ccc1N=Nc1c(O)c2c(N)cc(cc2cc1S([O-])(=O)=O)S([O-])(=O)=O)-c1ccc(N=Nc2c(O)c3c(N)cc(cc3cc2S([O-])(=O)=O)S([O-])(=O)=O)c(C)c1 |w:8.9,33.35|
Cc1cc(ccc1N=Nc1ccc2c(cc(c(N)c2c1O)S([O-])(=O)=O)S([O-])(=O)=O)-c1ccc(N=Nc2ccc3c(cc(c(N)c3c2O)S([O-])(=O)=O)S([O-])(=O)=O)c(C)c1 |w:34.37,7.7|
COc1cc(c(C)cc1N=Nc1c(O)ccc2cc(ccc12)S([O-])(=O)=O)S([O-])(=O)=O |w:10.11|
Oc1cc(cc2cc(cc(O)c12)S([O-])(=O)=O)S([O-])(=O)=O
C\C(=C1\C=CC(=O)C(=C1)C(O)=O)c1ccc(O)c(c1)C(O)=O |c:3,7|
CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)[C@@H](NC(=O)\C(=C\C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(O)=O)C(O)=O
CO[C@H]([C@H](O)CC(=O)[C@@H](C)[C@@H](O)CC[C@@H](C)[C@@H]1O[C@]2(CC[C@@H](C)[C@H](CC[C@H](C)C(C)=O)O2)CC[C@@H]1C)[C@H](OC(=O)C[C@@H](O)C1=C(C)C(=O)OC1=O)C(C)C |r,c:45|
COC[C@@H]([C@H](O)[C@H](O)C(=O)N[C@H](C)C[C@H](C)c1nc(\C=C\CC2O[C@]3(CC(O)C2C)OC([C@H](C[C@H](O)[C@H](C)[C@H](O)[C@H](C)\C=C(/C)\C(\C)=C\C=C\C(\C)=C/C#N)OC)[C@H](OP(O)(O)=O)C3(C)C)co1)N(C)C
OP(O)(=O)C(F)(F)c1ccc(COc2ccc(OCc3ccc(cc3)C(F)(F)P(O)(O)=O)cc2)cc1
[O-]C(=O)c1ccc(CNC(=O)c2cc(NC(=O)CCc3ccc(cc3)C(F)(F)P([O-])([O-])=O)cc(NC(=O)CCc3ccc(cc3)C(F)(F)P([O-])([O-])=O)c2)cc1
OP(O)(=O)C(F)(F)c1ccc(COc2cccc(OCc3ccc(cc3)C(F)(F)P(O)(O)=O)c2)cc1
OP(O)(=O)C(F)(F)c1ccc(COc2ccccc2OCc2ccc(cc2)C(F)(F)P(O)(O)=O)cc1
[O-]P([O-])(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)P([O-])([O-])=O
[O-]P([O-])(=O)C(F)(F)c1ccc(COCCOCc2ccc(cc2)C(F)(F)P([O-])([O-])=O)cc1
[O-]P([O-])(=O)C(F)(F)c1ccc(CCCCc2ccc(cc2)C(F)(F)P([O-])([O-])=O)cc1
[O-]C(=O)c1ccc(cc1)N1C(=S)S\C(=C\C=C\c2ccccc2)C1=O
COC(=O)c1ccc2nc(NC(=O)COC(=O)c3ccc(Br)o3)sc2c1
Clc1ccc(cc1)-c1cc(NC(=O)Nc2ccccc2)n(n1)-c1ccccc1
Oc1cc(ccc1C([O-])=O)-c1ccc(\C=C2\S\C(=N/c3ccccc3)N(C2=O)c2ccccc2)o1
Oc1cccc(c1)-c1nc(c([nH]1)-c1ccc(cc1)-c1ccccc1)-c1ccc(cc1)-c1ccccc1
CSc1n[nH]c(NC(=O)c2ccc(Cl)c(Cl)c2)c1S(=O)(=O)c1ccc(Cl)cc1
[#8-]-[#7+](=O)-c1ccc2nc(-[#16]-c3ccc(\[#6]=[#6]-4/[#6](=O)-[#7]-[#6](=O)-[#7]-[#6]-4=O)cc3-[#7+](-[#8-])=O)sc2c1
CCOc1cc(\C=C2\N=C(OC2=O)c2ccc3OCOc3c2)cc(Cl)c1OC(C)=O |c:8|
[O-]C(=O)c1ccc(\C=C2\SC(=S)N(Cc3ccccc3)C2=O)cc1
Oc1ccc(NC(=O)C(\NC(=O)c2ccccc2)=C\c2c[nH]c3ccccc23)cc1
[O-]C(=O)c1ccc(cc1Cl)-c1ccc(C=c2c(=C)[nH]n(-c3cccc(Cl)c3)c2=O)o1 |w:14.14|
c1ccc2c(c1)cc(s2)C(=O)O
CCCCCNC(=O)[C@H](Cc1ccc(c2c1cccc2)N(c3ccccc3C(=O)O)C(=O)C(=O)O)NC(=O)C
c1ccc2c(c1)cccc2N(c3ccccc3C(=O)O)C(=O)C(=O)O
CCCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(CC)c1)NC(C)=O
[#6]-[#6]-[#6@@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6](-[#6]-c1ccc(-[#8]-[#6]-[#6](-[#8])=O)c(c1)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#7])=O
CCC(C)[C@H](NC(=O)C(Cc1ccc(OCC(O)=O)c(c1)C(O)=O)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(N)=O
[#6]-[#6]-[#6@@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6](-[#6]-c1ccc(-[#8]-[#6]-[#6](-[#8])=O)c(c1)-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](-[#6])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6]-[#6](-[#7])=O
CC1(C)CC[C@]2(C)CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)C5CC[C@@]34C)[C@@H]2C1 |c:13|
CC(=O)O[C@H]1CC[C@@]2(C)C(CC[C@]3(C)[C@@H]2CC=C2[C@@H]4CC(C)(C)CC[C@]4(C)CC[C@@]32C(O)=O)C1(C)C |t:17|
C[C@@H]1CC[C@]2(C)CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2[C@H]1C |c:12|
COC(=O)[C@@]12CCC3C(=CC[C@H]4[C@@]3(C)CCC3C(C)(C)[C@@H](O)CC[C@]43C)[C@@H]1CC(C)(C)CC2 |c:8|
CC1(C)CC[C@]2(C)CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5[C@H](O)C[C@@]34C)[C@@H]2C1 |c:13|
CC1(C)[C@@H](O)CC[C@@]2(C)C1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O |t:19|
CC1(C)CC[C@]2(C)CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1 |r,c:13|
COC(=O)[C@@]12CC[C@@]3(C)CCC(C)(C)C[C@H]3C1=CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)C3CC[C@@]21C |c:18|
CC1(C)CC[C@]2(C)CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@@]34C)[C@@H]2C1 |c:13|
[H][C@@]12C[C@](C)(CC[C@]1(C)CC[C@]1(C)C2=CC(=O)[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)C3CC[C@@]12C)C(O)=O |r,t:15|
CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)O[C@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C(O)=O |r,t:18|
CC(C)CC(=O)OC[C@H]1C[C@]23C[C@H]1CCC2[C@]1(C)CCC[C@](C)(C1CC3)C(O)=O
C[C@@]1(CC=C2C(CCC3[C@](C)(CO)CCC[C@@]23C)C1)C=C |c:3|
C[C@@]1(O)C[C@]23C[C@H]1CCC2[C@]1(C)CCC[C@](C)(C1CC3)C(O)=O
C[C@@]1(CC=C2C(CCC3[C@@](C)(CCC[C@@]23C)C(O)=O)C1)C=C |c:3|
CC(C)CC(=O)OC[C@@]1(O)C[C@]23C[C@H]1CCC2[C@]1(C)CCC[C@](C)(C1CC3)C(O)=O
C[C@]1(CC[C@@]2(O)[C@@H](C1)C(=O)CC1[C@@](C)(CCC[C@@]21C)C(O)=O)C=C
C[C@@]1(CCC2C(=C1)[C@@H](O)CC1[C@@]2(C)CCC[C@@]1(C)C(O)=O)C=C |c:5|
C[C@@]12CCC[C@](C)([C@H]1CC[C@@]13C[C@H](CC[C@@H]21)C(=C)C3)C(O)=O |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc2ccoc12)-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1
COc1cc(cc2C=CC(C)(C)Oc12)C1CC(=O)c2c(O)cc(O)cc2O1 |c:7|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(-[#6@@H]-2-[#6]-[#6](=O)-c3c(-[#8])cc(-[#8])cc3-[#8]-2)c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#6]-[#6](-[#8])-[#6](-[#6])=[#6])c1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
CC1(C)Oc2ccc(cc2C=C1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |c:11|
CC1(C)Oc2c(O)cc(cc2C=C1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |c:12|
[#6]-[#8]-c1cc(cc(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2-[#8]C([#6])([#6])[#6]=[#6]-c2cc1-[#6@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |c:13|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-c1cc(=O)c2c(-[#8])cc(-[#8])cc2o1
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(\[#6]=[#6]\[#6](=O)-c2ccc(-[#8])cc2-[#8])cc(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8]
OC(=O)C1C=C(Cc2cc(C(O)=O)c(O)c(c2)-c2ccco2)CC(c2ccco2)C1=O |t:4|
OC(=O)c1cc(Cc2cc(Cl)c(O)c(c2)C(O)=O)cc(Cl)c1O
Cc1cc(Cc2cc(C)c(O)c(c2)C(O)=O)cc(C(O)=O)c1O
COc1cc(Cc2cc(OC)c(O)c(c2)C(O)=O)cc(C(O)=O)c1O
OC(=O)C1C=C(Cc2cc(Cc3ccccc3)c(O)c(c2)C(O)=O)CC(Cc2ccccc2)C1=O |t:4|
c1cc(c(cc1Cc2ccc(c(c2)C(=O)O)O)C(=O)O)O
OC(=O)c1cc(Cc2cc(Br)c(O)c(c2)C(O)=O)cc(Br)c1O
Oc1cccc(\C=C\c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)c1O
COC(=O)\C=C\c1ccc(\C=C\c2ccc(O)c(O)c2)cc1
Oc1ccc(\C=C\c2ccc(C=O)cc2)cc1O
COC(=O)c1ccc(\C=C\c2ccc(O)c(O)c2)cc1
OCc1ccc(\C=C/c2ccc(O)c(O)c2)cc1
Oc1ccc(\C=C\c2ccc(cc2)C(=O)Nc2ccccc2)cc1O
Oc1ccc(\C=C\c2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1O
Oc1ccc(\C=C\c2ccc(cc2)C(=O)NCC2CCCO2)cc1O |w:17.17|
OCc1ccc(\C=C\c2ccc(O)c(O)c2)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3ccc(O)cc3)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3ccc4ccccc4c3)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3cccc(Oc4ccccc4)c3)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3cccc4ccccc34)C2=O)cc1
COc1cc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1O
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3cccc(O)c3)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3cccc(OCc4ccccc4)c3)C2=O)cc1
OC(=O)COc1ccc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3ccc(Oc4ccccc4)cc3)C2=O)cc1
OC(=O)COc1c(O)cc(cc1OCc1ccccc1)-c1ccc(cc1)C(F)(F)F
OC(=O)COc1c(O)cc(cc1OCc1ccccc1)-c1ccccc1
OC(=O)COc1c(O)cc(Br)cc1OCc1ccc(cc1)C(F)(F)F
OC(=O)COc1c(O)cccc1OCc1ccc(cc1)C(F)(F)F
OC(=O)COc1c(O)cc(cc1OCc1ccc(cc1)C(F)(F)F)-c1ccccc1
OC(=O)COc1c(O)cc(Br)cc1OCc1ccccc1
OC(=O)COc1c(O)cc(cc1OCc1ccc(cc1)C(F)(F)F)-c1ccc(cc1)C(F)(F)F
OC(=O)COc1c(O)cc(cc1OCc1ccc(cc1)C(F)(F)F)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
COc1cc(COc2cc(cc(O)c2OCC(O)=O)-c2ccccc2)cc(OC)c1
OC(=O)COc1c(O)cccc1OCc1ccccc1
OC(=O)COc1c(O)cc(cc1OCc1ccccc1)-c1cccc(c1)C(F)(F)F
OC(=O)COc1c(O)cc(cc1OCc1ccccc1)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F
OC(=O)COc1c(O)cc(cc1O)-c1ccccc1
OC(=O)COc1c(O)cc(cc1OCc1ccc(cc1)C(F)(F)F)-c1cccc(c1)C(F)(F)F
CC(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)(c1ccccc1)n1nnc2ccccc12 |w:1.0|
OP(O)(=O)C(F)(F)c1cc2ccc(cc2cc1Br)C#N
OP(O)(=O)C(F)(F)c1cc2cc(CC#N)ccc2cc1Br
CS(=O)(=O)Cc1ccc2cc(Br)c(cc2c1)C(F)(F)P(O)(O)=O
CC(=O)NCc1ccc2cc(Br)c(cc2c1)C(F)(F)P(O)(O)=O
Cc1ccc2cc(Br)c(cc2c1)C(F)(F)P(O)(O)=O
NC(=O)c1ccc2cc(Br)c(cc2n1)C(F)(F)P(O)(O)=O
CNC(=O)c1ccc2cc(Br)c(cc2n1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1cc2nc(ccc2cc1Br)C(=O)Nc1cccc(F)c1
OP(O)(=O)C(F)(F)c1cc2nc(ccc2cc1Br)C(=O)Nc1ccccc1
OC(=O)c1cccc(\C=C\c2ccc3cc(Br)c(cc3n2)C(F)(F)P(O)(O)=O)c1
Cc1ccc2cc(Br)c(cc2n1)C(F)(F)P(O)(O)=O
Cc1ccc2ccc(cc2n1)C(F)(F)P(O)(O)=O
COCc1ccc2cc(Br)c(cc2c1)C(F)(F)P(O)(O)=O
OP(O)(=O)C(F)(F)c1cc2ccccc2cc1Br
OP(O)(=O)C(F)(F)c1cc2nc(ccc2cc1Br)C(=O)NCc1ccccc1
OP(O)(=O)C(F)(F)c1cc2nc(\C=C\c3ccccc3)ccc2cc1Br
COc1cc(O)c2C(=O)C[C@H]3[C@@H]4[C@@H](Oc5ccccc35)c3cccc(O)c3-c1c24 |r|
Cc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc(C)c1OC(Cc1ccccc1)C(O)=O |w:32.35|
Cc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc(C)c1OC(Cc1ccccc1)C(O)=O |w:37.40|
CC(C(O)=O)(C(O)=O)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1
COc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)ccc1OC(F)(F)C(O)=O
COc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)ccc1OC(F)(F)C(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(OC(F)(F)C(O)=O)c(Br)c1
OC(=O)C(=O)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)C(=O)C(O)=O)Cc1ccc(cc1)-c1csnn1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)C(F)(F)C(O)=O
OC(=O)C(=O)N(c1ccccc1)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)C(=O)Nc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1Br
OC(=O)C(=O)Nc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1C(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(NC(=O)C(O)=O)c(c1)C(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc2oc(cc2c1)C(O)=O
OC(=O)CS(=O)(=O)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)S(=O)(=O)CC(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(cc1)S(=O)CC(O)=O
OC(=O)CSc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1C(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(OCC(O)=O)c(c1)C(O)=O
Cc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)ccc1OCC(O)=O
OC(=O)COc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1Br
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(OCC(O)=O)c(Br)c1
OC(=O)COc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1Cl
OC(=O)COc1c(F)cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1F
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1cc(F)c(OCC(O)=O)c(F)c1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1cccc(OC(F)(F)C(O)=O)c1
OC(=O)C(F)(F)Oc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(OC(F)(F)C(O)=O)cc1)Cc1ccc(cc1)-c1csnn1
OC(=O)COc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1
OP(O)(=O)Cc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(CP(O)(O)=O)cc1)Cc1ccc(cc1)-c1csnn1
CC(C(O)=O)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)cc1 |w:1.0|
OC(=O)C(F)(F)Oc1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1Br
OC(=O)C(F)(F)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1)Cc1ccc(cc1)-c1csnn1
OC(=O)c1cc2cc(CN(Cc3ccc(cc3)-c3csnn3)S(=O)(=O)c3ccccc3)ccc2o1
OC(=O)CS(=O)c1ccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)cc1
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(SCC(O)=O)cc1)Cc1ccc(cc1)-c1csnn1
Cc1cc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccc(OCC(O)=O)cc2)ccc1OCC(O)=O
OC(=O)COc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)-c1csnn1)Cc1ccc(OCC(O)=O)c(Cl)c1
OC(=O)C(F)(F)Oc1cccc(CN(Cc2ccc(cc2)-c2csnn2)S(=O)(=O)c2ccccc2)c1
OC(=O)c1cc2c(-c3cn(CCCC(=O)Nc4cccc5ccccc45)nn3)c(oc2cc1O)-c1ccccc1
COC(=O)CC[C@H](NC(C)=C1C(=O)C=C2Oc3c(c(O)c(C)c(O)c3C(C)=O)[C@@]2(C)C1=O)C(O)=O |r,w:8.8,t:13|
CC(=O)C1C(=O)C=C2Oc3c(c(O)c(C)c(O)c3C(C)=O)[C@@]2(C)C1=O |r,t:6|
CC(=O)c1c2OC3=CC(=O)C(=C(C)N[C@@H](CCC(O)=O)C(O)=O)C(=O)[C@]3(C)c2c(O)c(C)c1O |r,w:11.11,t:6|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])cc(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])cc(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1 |r|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])cc(\[#6]=[#6]\[#6](=O)-c2ccc(-[#8])cc2-[#8])cc1-[#6]\[#6]=[#6](\[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc2-[#6]=[#6]C([#6])([#6])[#8]-c12)-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r,c:10|
CC1(C)Oc2cc3occ(-c4ccc(O)cc4)c(=O)c3c(O)c2C=C1 |c:26|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])cc(cc1\[#6]=[#6]\C([#6])([#6])[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2ccc(-[#8])cc2-[#8]-1 |r|
COc1ccc(\C=C\C(=O)c2ccc(O)cc2O)cc1
c1cc(ccc1C=CC(=O)c2ccc(cc2O)O)O
COc1cc(OC)c2c(c1)occ(-c1ccc(O)cc1)c2=O
NS(=O)(=O)c1cc(ccc1Br)-c1ccc(CSCc2ccc(CS([O-])(=O)=O)c(Br)c2)cc1
NS(=O)(=O)c1cc(ccc1Br)-c1ccc(CSCc2ccc(c(Br)c2)C(F)(F)S([O-])(=O)=O)cc1
CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc(c1)C(F)(F)P([O-])([O-])=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(O)=O)C(N)=O |r|
NS(=O)(=O)c1cc(ccc1Br)-c1ccc(CSCc2ccc(c(Br)c2)C(F)(F)P([O-])([O-])=O)cc1
NS(=O)(=O)C(F)(F)c1cc(ccc1Br)-c1ccc(CSCc2ccc(c(Br)c2)C(F)(F)S([O-])(=O)=O)cc1
NS(=O)(=O)C(F)(F)c1cc(ccc1Br)-c1ccc(CSCc2ccc(c(Br)c2)C(F)(F)P([O-])([O-])=O)cc1
CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc(c1)C(F)(F)S([O-])(=O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(O)=O)C(N)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](Cc1cccc(CS(O)(=O)=O)c1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(O)=O)C(N)=O |r|
CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](O[C@H]([C@@H]1OC(C)=O)C1=CC(=O)C=CC1=O)C(O)=O |r,c:23,t:19|
CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](O[C@H]([C@@H]1OC(C)=O)C1=CC(=O)C=CC1=O)C(O)=O |r,c:23,t:19|
CC(=O)O[C@H]1[C@H](OC(C)=O)[C@H](O[C@H]([C@@H]1OC(C)=O)C1=CC(=O)c2ccccc2C1=O)C(O)=O |r,t:19|
CC(=O)O[C@H]1[C@@H](OC(C)=O)[C@H](O[C@H]([C@@H]1OC(C)=O)C1=CC(=O)c2ccccc2C1=O)C(O)=O |r,t:19|
OC(=O)[C@H]1O[C@H]([C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1)C1=CC(=O)c2ccccc2C1=O |r,t:40|
COc1ccc(OC)c(c1)[C@@H]1O[C@H](CNC(=O)c2ccccc2C(O)=O)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
COc1cc([C@@H]2O[C@H](CN=[N+]=[N-])[C@@H](OC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(OC)c2ccccc12 |r|
COc1cc([C@@H]2O[C@H](CNC(=O)c3ccccc3C(O)=O)[C@@H](OC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)c(OC)c2ccccc12 |r|
COc1ccc(OC)c(c1)[C@@H]1O[C@H](CNC(=O)c2ccccc2)[C@@H](O)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
COc1ccc(OC)c(c1)[C@@H]1O[C@H](CNC(=O)c2ccccc2)[C@@H](OC(C)=O)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1 |r|
O[C@@H]1[C@@H](CNC(=O)c2ccccc2)O[C@H]([C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1)C1=CC(=O)C=CC1=O |r,c:43,t:39|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O |r,c:9|
C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C |r,c:11|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@@H]1O)C(O)=O |r,c:10|
C[C@@]1(CO)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:11|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(O)=O |r,c:10|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CCC(=O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O |r,c:9|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O |r,c:9|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |r,c:9|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O |r,c:9|
C[C@]1(O)[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O |r,t:4|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]34C)C(O)=O)[C@@H]2[C@]1(C)O)C(O)=O |r,c:9|
C[C@]1(O)[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@@H](O)[C@@](C)([C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O)C(O)=O |r,t:4|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(cc(-[#8])c2-[#8]C([#6])([#6])[#6]=[#6]-c12)-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r,c:15|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc2-[#6]-[#6](-[#8])C([#6])([#6])[#8]-c12)-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
COc1cc(cc2C=CC(C)(CO)Oc12)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r,c:7|
COc1cc(cc2CC(O)C(C)(C)Oc12)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2-[#8]C([#6])([#6])[#6](-[#8])-[#6](-[#8])-c2cc1-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])cc(cc1\[#6]=[#6]\C([#6])([#6])[#8])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc2-[#6](-[#8])-[#6](-[#8])C([#6])([#6])[#8]-c12)-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])cc(cc1\[#6]=[#6]\[#6](-[#6])=[#6])-[#6@@H]-1-[#6]-[#6](=O)-c2c(-[#8])cc(-[#8])cc2-[#8]-1 |r|
CC1(CO)Oc2c(O)cc(cc2C=C1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r,c:13|
CC1(C)Oc2c(C=C1)cc([C@@H]1CC(=O)c3c(O)cc(O)cc3O1)c1C=CC(C)(C)Oc21 |r,c:6,27|
CC1(C)Oc2ccc(cc2C(O)C1O)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
CC1(C)CC(=O)c2cc(cc(O)c2O1)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
CC1(C)Oc2c(O)cc(cc2CC1O)[C@@H]1CC(=O)c2ccc(O)cc2O1 |r|
CC1(C)Oc2c(O)cc(cc2C(O)C1O)[C@@H]1CC(=O)c2ccc(O)cc2O1 |r|
CC1(C)Oc2c(O)cc(cc2C[C@@H]1O)[C@@H]1CC(=O)c2c(O)cc(O)cc2O1 |r|
CC1(C)C2C(O)C(O)C(O)OC2C(=O)C(=O)C1C1CC(=O)c2ccccc2O1
CCCCCc1cc(O)cc(O)c1Oc1cc(OC)cc2c1C(=O)OC2(CCCC)OC
COC(=O)c1c(C)cc(OC(=O)c2c(C)cc(O)c(C=O)c2O)c(C)c1O
COC(=O)c1c(C)cc(O)cc1O
COC(=O)c1c(C)cc(O)c(C=O)c1O
COc1cc(O)c(C(C)=O)c(O)c1C
CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(O)c1C(=O)OC
CCCCCc1c2Oc3cc(OC)cc(C(=O)CCCC)c3C(=O)Oc2cc(OC)c1C(=O)OC
OC(=O)c1ccc(Nc2cc3ccccc3cc2NS(=O)(=O)c2ccc(F)cc2)cc1
OC(=O)c1cc(ccc1Cl)-c1ccc(C=C2NC(=O)N(C2=O)c2ccccc2)o1 |w:14.14|
COc1cc(C)ccc1OCCn1cccc1C=C1C(=O)NC(=O)N(C1=O)c1ccc(C)c(Cl)c1 |w:17.18|
O=C1NC(=O)C(=Cc2cn(Cc3cccc4ccccc34)c3ccccc23)C(=O)N1c1ccccc1 |w:6.6|
Clc1ccccc1COc1ccccc1\C=C1\C(=O)ON=C1c1ccccc1 |c:22|
OC1=NC(=O)C(S1)=Cc1ccc(OCc2ccc(F)cc2)c(Br)c1 |w:7.8,t:1|
OC(=O)c1ccccc1-c1ccc(\C=C(/C#N)C(=O)Nc2ccc3ccccc3c2)o1
CCOc1ccc(cc1)-c1csc(n1)C(CNc1ccc2oc(=O)ccc2c1)C#N
OC(=O)c1cccc(c1)-c1ccc(o1)-c1nc2sc3CCCCc3c2c(=O)[nH]1
COc1cc(O)ccc1\C=C\C(=O)c1ccc(O)cc1
[#6]-[#8]-c1c(\[#6]=[#6]\[#6](=O)-c2ccc(-[#8])cc2)ccc(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]
COc1cc(O)c(cc1\C=C\C(=O)c1ccc(O)cc1)C(C)C(C)=C
COc1ccc(cc1)C(=O)\C=C\c1cc(c(O)cc1OC)C(C)(C)C=C
COc1ccc(cc1)C(=O)\C=C\c1cc(c(OC)cc1OC)C(C)(C)C=C
COc1cc(O)c(cc1\C=C\C(=O)c1ccc(OC(C)=O)cc1)C(C)(C)C=C
COc1cc(OC(C)=O)c(cc1\C=C\C(=O)c1ccc(OC(C)=O)cc1)C(C)(C)C=C
COc1cc(OC)c(cc1\C=C\C(=O)c1ccc(O)cc1)C(C)(C)C=C
COc1cc(OC(C)=O)c(cc1\C=C\C(=O)c1ccc(O)cc1)C(C)(C)C=C
COc1ccc(cc1)C(=O)\C=C\c1cc(c(OC(C)=O)cc1OC)C(C)(C)C=C
COc1cc(OC)c(cc1\C=C\C(=O)c1ccc(OC(C)=O)cc1)C(C)(C)C=C
[#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]-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]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc2cc(oc12)-c1cc(-[#8])cc(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]
[#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]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])cc(-[#8])cc1-c1cc2ccc(-[#8])cc2o1
[#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|
CCOC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1ccccc1OC
CCOC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1cccc(OC)c1
CCOC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1ccc(OC)cc1
CCOC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1ccc(F)cc1
CCOC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1ccc(F)c(Cl)c1
CC(C)OC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1cccc(c1)-c1ccccc1
CCOC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1ccccc1
CCc1oc2cc(ccc2c1C(=O)c1cc(Br)c(O)c(Br)c1)S(=O)(=O)Nc1nccs1
CC(C)OC(=O)c1c(NC(=O)C2C3CCC(C3)C2C(O)=O)scc1-c1ccc2ccccc2c1 |TLB:18:17:14.13:16,THB:9:11:14.13:16|
CC(C)OC(=O)c1c(NC(=O)C2C3CC(C=C3)C2C(O)=O)scc1-c1ccc(cc1)-c1ccccc1 |c:15,TLB:9:11:15.16:13,THB:18:17:15.16:13|
CC(C)OC(=O)c1c(NC(=O)c2ccccc2C(O)=O)scc1-c1ccc(cc1)-c1ccccc1
CC(C)OC(=O)c1c(NC(=O)C2C3CC(C=C3)C2C(O)=O)scc1-c1ccc(cc1)-c1ccc(Cl)cc1 |c:15,TLB:9:11:15.16:13,THB:18:17:15.16:13|
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc2-[#6@@H]3-[#8]-c4c(ccc5-[#8]C([#6])([#6])[#6]=[#6]-c45)[C@]3([#8])[#6]-[#8]-c2cc1-[#8] |r,c:19|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2-[#6@@H]-3-[#6]-[#8]-c4c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])ccc4-[#6@@H]-3-[#8]-c2cc1-[#8] |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c2-[#8]-[#6@@H]-3-[#6@@H](-[#6]-[#8]-c4cc(-[#8])ccc-34)-c2ccc1-[#8] |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2-[#6@@H]-3-[#6]-[#8]-c4cc(-[#8])ccc4-[#6@@H]-3-[#8]-c2cc1-[#8] |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2-[#6@@H]-3-[#8]-c4c(ccc(-[#8])c4-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@@H]-3-[#6]-[#8]-c2cc1-[#8] |r|
[#6]-[#8]-c1ccc2c(-[#8]-[#6@H]3-c4cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc4-[#8]-[#6][C@@]23[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6] |r|
[#6]-[#8]-c1ccc2c(-[#8]-[#6@H]3-c4ccc(-[#8])cc4-[#8]-[#6][C@@]23[#8]-[#6])c1-[#6]\[#6]=[#6](\[#6])-[#6] |r|
Oc1ccc2[C@@H]3Oc4c(ccc(O)c4C=O)[C@@H]3COc2c1 |r|
[#6]-[#8]-c1cc2-[#6@@H]-3-[#6]-[#8]-c4cc(-[#8]-[#6])c(-[#6]\[#6]=[#6](\[#6])-[#6])cc4-[#6@@H]-3-[#8]-c2cc1-[#8] |r|
[#6]-[#8]-c1cc2-[#6@@H]-3-[#6]-[#8]-c4cc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])cc4-[#6@@H]-3-[#8]-c2cc1-[#8] |r|
CC1(C)Oc2cc3OC[C@@H]4[C@@H](Oc5cc(O)ccc45)c3cc2C=C1 |r,c:26|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc2-[#6@@H]-3-[#8]-c4c(ccc5-[#8]C([#6])([#6])[#6]=[#6]-c45)-[#6@@H]-3-[#6]-[#8]-c12 |r,c:22|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc2-[#6@@H]-3-[#8]-c4cc(-[#8])ccc4-[#6@@H]-3-[#6]-[#8]-c12 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2-[#6@@H]-3-[#8]-c4c(ccc5-[#8]C([#6])([#6])[#6]=[#6]-c45)-[#6@@H]-3-[#6]-[#8]-c2cc1-[#8] |r,c:19|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc2-[#6@@H]-3-[#8]-c4c(ccc5-[#6]=[#6]C([#6])([#6])[#8]-c45)-[#6@@H]-3-[#6]-[#8]-c12 |r,c:18|
COc1ccc(OC)c(c1)C(=O)\C=C\c1cccc2ccccc12
Oc1ccccc1C(=O)\C=C\c1cccc2ccccc12
COc1ccc(OC)c(c1)C(=O)\C=C\c1ccc2ccccc2c1
COc1cc(ccc1O)C(=O)\C=C\c1ccc2ccccc2c1
COc1ccc(cc1OC)C(=O)\C=C\c1ccc2ccccc2c1
COc1c(CC=C(C)C)c(O)cc(O)c1-c1oc2cc(O)ccc2c1C |(1.96,-4.21,;1.2,-2.87,;1.98,-1.54,;3.51,-1.55,;4.28,-2.88,;5.82,-2.89,;6.59,-4.22,;5.82,-5.55,;8.13,-4.23,;4.29,-.21,;5.83,-.22,;3.51,1.12,;1.98,1.12,;1.2,2.45,;1.22,-.21,;-.32,-.2,;-1.23,1.05,;-2.69,.57,;-4.03,1.33,;-5.35,.56,;-6.69,1.32,;-5.34,-.98,;-4.01,-1.74,;-2.7,-.97,;-1.23,-1.45,;-.76,-2.91,)|
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2oc(cc12)-c1ccc(-[#8])cc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(cc(-[#8])c1-[#8])-c1coc2cc(-[#8])cc(-[#8])c2c1=O
[#6]-[#8]-c1cc(-[#8])cc2occ(-c3cc(-[#8])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c3)c(=O)c12
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2c(cc1-[#8])oc(cc2=O)-c1ccc(-[#8])cc1
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2oc(=O)c(cc12)-c1ccc(-[#8])cc1-[#8]
OC(=O)c1cc(NCn2c3ccccc3[nH]c2=S)ccc1O
c1ccc(c(c1)C(=O)O)O
N[C@@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(O)=O |r|
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(cc2)C(F)(F)F)=C\c2ccc(OCc3ccccc3)cc2)cc1
COc1ccc(cc1)\N=C1/S\C(=C/c2ccc3ccccc3c2)C(=O)N1Cc1ccc(cc1)C(O)=O
COc1ccc(cc1)\N=C1/S\C(=C/c2ccc(OCc3ccccc3)cc2)C(=O)N1Cc1ccc(cc1)C(O)=O
COc1ccc(cc1)\N=C1/S\C(=C/c2cccc(OCc3ccccc3)c2)C(=O)N1Cc1ccc(cc1)C(O)=O
COc1ccc(cc1)\N=C1/S\C(=C/c2ccc(Oc3ccccc3)cc2)C(=O)N1Cc1ccc(cc1)C(O)=O
COc1ccc(cc1)\N=C1/S\C(=C/c2cccc(Oc3ccccc3)c2)C(=O)N1Cc1ccc(cc1)C(O)=O
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc4ccccc4c3)C2=O)=N\c2ccc(cc2)C(F)(F)F)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(cc2)C(F)(F)F)=C\c2cccc(OCc3ccccc3)c2)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(cc2)C(F)(F)F)=C\c2cccc(Oc3ccccc3)c2)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(cc2)C(F)(F)F)=C\c2ccc(Oc3ccccc3)cc2)cc1
Cn1nc(cc1C(O)=O)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1cc(no1)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1cc(n[nH]1)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1coc(n1)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1csc(n1)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1ccc([nH]1)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)C1CN(C(=O)C1)c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)C1CCN(C1=O)c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1onc(c1C(O)=O)-c1ccc(CC(C(=O)c2ccccc2)c2ccccc2)cc1
OC(=O)c1cc(no1)-c1ccc(CC(C(=O)c2cc(F)cc(F)c2)c2ccc(F)cc2)cc1
OC(=O)c1cc(no1)-c1ccc(CC(C(=O)c2ccc(F)cc2)c2ccc(F)cc2)cc1
OC(=O)c1cc(no1)-c1ccc(CC(C(=O)c2ccc(F)c(F)c2)c2ccc(F)cc2)cc1
OC(=O)c1cc(no1)-c1ccc(CC(C(=O)c2ccc(Cl)cc2)c2ccc(F)c(F)c2)cc1
OC(=O)c1csc(n1)-c1ccc(CC(C(=O)c2ccc(F)c(F)c2)c2ccc(F)cc2)cc1
OC(=O)c1csc(n1)-c1ccc(CC(C(=O)c2ccc(Cl)cc2)c2ccc(F)c(F)c2)cc1
OC(=O)c1cc(no1)-c1ccc(CC(c2nc(no2)-c2ccccc2)c2ccccc2)cc1
COc1ccc(cc1)-c1noc(n1)C(Cc1ccc(cc1)-c1cc(on1)C(O)=O)c1ccc(F)cc1
COc1ccc(cc1)C(Cc1ccc(cc1)-c1cc(on1)C(O)=O)c1nc(no1)-c1ccc(Cl)cc1
OC(=O)c1csc(n1)-c1ccc(CC(c2nc(no2)-c2cccc(F)c2)c2ccc(F)cc2)cc1
COc1ccc(cc1)C(Cc1ccc(cc1)-c1nc(cs1)C(O)=O)c1nc(no1)-c1cccc(F)c1
Oc1cc(Cc2cc(O)c(O)c(Br)c2Br)c(Br)c(Br)c1O
COc1c(Br)c(Br)c(C(=O)c2c(Br)c(Br)c(OC)c(OC)c2Br)c(Br)c1OC
Oc1cc(C(=O)c2c(Br)c(O)c(O)c(Br)c2Br)c(Br)c(Br)c1O
Oc1c(O)c(Br)c(Cc2c(Br)c(O)c(O)c(Br)c2Br)c(Br)c1Br
CCOC(=O)C(=O)Nc1nc2ccc(C)cc2s1
CCOC(=O)C(=O)Nc1nc2ccc(Cl)cc2s1
CCOC(=O)C(=O)Nc1nc2ccc(F)cc2s1
OC(=O)CCc1cccc(c1)[Sb](O)(O)=O
OC(=O)\C=C\c1cccc(c1)[Sb](O)(O)=O
CCCCCCCCCCCCCCCC(NCc1ccccc1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1cccc(C)c1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1cccc(Cl)c1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1cccc(F)c1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccc(C)cc1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1cccc(O)c1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1cccc(OC)c1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1cccc(c1)N(C)C)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccc(Cl)cc1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccc(F)cc1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccc(O)cc1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccc(OC)cc1)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccc(cc1)N(C)C)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccccc1C)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccccc1Cl)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccccc1F)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccccc1O)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccccc1OC)=C1C(=O)OC(CO)C1=O |w:15.15|
CCCCCCCCCCCCCCCC(NCc1ccccc1N(C)C)=C1C(=O)OC(CO)C1=O |w:15.15|
CC(C)[C@@H]1C[C@@H](O)[C@H]2[C@@]1(CO)CC[C@@]1(C)[C@@H]3[C@@H](O)CC4=C(CC[C@H](O)C4(C)C)C3=CC[C@]21C |r,c:31,t:20|
CC(C)[C@@H]1[C@H](O)[C@@H](O)[C@H]2[C@@]1(CO)CC[C@@]1(C)[C@@H]3[C@@H](O)CC4=C(CC[C@H](O)C4(C)C)C3=CC[C@]21C |r,c:32,t:21|
CC(C)[C@@H]1CC(=O)[C@H]2[C@@]1(CO)CC[C@@]1(C)[C@@H]3[C@@H](O)CC4=C(CC[C@H](O)C4(C)C)C3=CC[C@]21C |r,c:31,t:20|
CC(C)[C@@H]1C[C@@H](O)[C@H]2[C@@]1(CO)CC[C@@]1(C)[C@@H]3[C@@H](O)CC4=C(CC[C@H](O)[C@@]4(C)CO)C3=CC[C@]21C |r,c:32,t:20|
CC(C)[C@@H]1C[C@@H](O)[C@H]2[C@@]1(CO)CC[C@@]1(C)[C@@H]3[C@@H](O)C[C@H]4C(=CC[C@H](O)C4(C)C)C3=CC[C@]21C |r,c:21,31|
C[C@@H]1CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2[C@]1(C)O)C(O)=O |r,c:9|
C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O |r,t:3|
C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@]2(CCC1=C)C(O)=O |r,t:3|
OS(=O)(=O)C(F)(F)c1ccc(cc1)-c1cccc(F)c1
COS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)cc1OCCc1nc(oc1C)-c1ccccc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCNc2nc(cs2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)cc1OCCc1csc(n1)-c1ccccc1
CCOc1ccc(cc1)-c1cc(COc2ccc(\C=C\S(=O)(=O)OCC)cc2)no1
CCOS(=O)(=O)\C=C\Cc1cc2ccc(OCCc3nc(oc3C)-c3ccccc3)cc2o1
CCOS(=O)(=O)\C=C\c1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1
CCCCOS(=O)(=O)\C=C\c1ccc(OCCc2csc(n2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)cc1OCCc1nc(oc1C)-c1ccccc1
CCCCOS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)cc1OCCc1nc(oc1C)-c1ccccc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)cc1OCCc1nc(sc1C)-c1ccccc1
CCOS(=O)(=O)\C=C\Cc1nc(sc1C)-c1ccccc1
CCOS(=O)(=O)\C=C\c1ccc(OCc2cc(on2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCNc2nc(cs2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccc(Br)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccc(F)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccccc2Cl)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccccn2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccc(cc2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2cccc(OC)c2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2cccc3ccccc23)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccccc2F)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(c(s2)-c2ccccc2)-c2ccccc2)c(OC)c1
CCOS(=O)(=O)\C=C\c1ccc(OC)c(OCCCCNc2nc(cs2)-c2ccccc2)c1
CCOS(=O)(=O)\C=C\c1ccc(OC)c(OCCCCNc2nc(c(s2)-c2ccccc2)-c2ccccc2)c1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(c(C)s2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2cccs2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(c(s2)-c2ccccc2)-c2ccccc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OC)c(OCCCCNc2nc(c(C)s2)-c2ccccc2)c1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccc(OC)cc2)cc1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(c(C)s2)-c2ccccc2)c(OC)c1
CCOS(=O)(=O)\C=C\c1ccc(OCCCCNc2nc(cs2)-c2ccccc2)cc1
CCCCOS(=O)(=O)\C=C\c1ccc(OCCc2nc(oc2C)-c2ccccc2)cc1
CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CCC(=O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(O)=O |c:32|
CC1(C)CC[C@@]2(CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)C2=C1)C(O)=O |r,c:32|
OC(=O)c1ccc(COc2ccc(\C=C3/S\C(=N/c4ccccc4)N(Cc4ccc(cc4)C(O)=O)C3=O)cc2)cc1
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc(ccc1-[#8])-c1coc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])ccc2c1=O
[#6]\[#6](-[#6])=[#6]\[#6]-c1c2-[#8]-[#6](-[#6]-c2c(-[#8])c2c1occ(-c1ccc(-[#8])cc1)c2=O)C([#6])([#6])[#8]
COc1cc2OC(C)(C)C=Cc2cc1[C@H]1COc2cc(O)cc(O)c2C1=O |r,c:9|
[#6]-[#8]-c1ccc(cc1-[#6]\[#6]=[#6](\[#6])-[#6])-[#6@H]-1-[#6]-[#8]-c2cc(-[#8])cc(-[#8])c2-[#6]-1=O |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2c(occ(-c3ccc(-[#8])cc3-[#8])c2=O)c(-[#6]\[#6]=[#6](\[#6])-[#6])c1-[#8]
COC(C(O)C(C)(C)O)c1c2OC(C)(C)C=Cc2c(O)c2c1occ(-c1ccc(O)cc1)c2=O |c:15|
CCOC(=O)C(CCCOc1cccc(OCCN2CCCC2)c1C(=O)CC)C(=O)OCC
CCOC(=O)C(CCCOc1cccc(OCCN(C)C)c1C(=O)CC)C(=O)OCC
CCC(=O)c1c(O)cccc1OCCCNc1ccc(OC)cc1
CCC(=O)c1c(O)cccc1OCCCNc1ccc(C)cc1
CCCCNCCCOc1cccc(O)c1C(=O)CC
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5[nH]nc(C(O)=O)c5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nnsc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nc(N)sc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nc(N)sc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:14|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nccnc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nccnc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:14|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nc(N)ncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
CCOC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nc(N)ncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:15|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5nc(C)ncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5ncncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5oncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5c(C[C@]4(C)[C@H]3CC[C@]12C)cnn5-c1ccccc1 |r,t:13|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5[nH]ncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
CCOC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)c5[nH]ncc5C[C@]4(C)[C@H]3CC[C@]12C |r,t:15|
COC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:14|
C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC=C4C(C)(C)C(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:13|
Clc1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5cc(Cl)ccc45)o3)c2c1
Cc1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5cc(Cl)ccc45)o3)c2c1
Clc1ccc2N(Cc3ccc(\C=C4\C(=O)Nc5ccccc45)o3)C(=O)C(=O)c2c1
Cc1ccc2N(Cc3ccc(\C=C4\C(=O)Nc5ccc(Cl)cc45)o3)C(=O)C(=O)c2c1
Cc1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5cc(C)ccc45)o3)c2c1
Cc1ccc2N(Cc3ccc(\C=C4\C(=O)Nc5ccc(Br)cc45)o3)C(=O)C(=O)c2c1
Cc1ccc2N(Cc3ccc(\C=C4\C(=O)Nc5ccccc45)o3)C(=O)C(=O)c2c1
Clc1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5ccccc45)o3)c2c1
[O-][N+](=O)c1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5ccccc45)o3)c2c1
Cc1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5ccccc45)o3)c2c1
Brc1ccc2NC(=O)\C(=C\c3ccc(CN4C(=O)C(=O)c5ccccc45)o3)c2c1
O=C1Nc2ccccc2\C1=C/c1ccc(CN2C(=O)C(=O)c3ccccc23)o1
Clc1ccc2N(Cc3ccc(C=O)o3)C(=O)C(=O)c2c1
Cc1ccc2N(Cc3ccc(C=O)o3)C(=O)C(=O)c2c1
O=Cc1ccc(CN2C(=O)C(=O)c3ccccc23)o1
CNc1nc(N)nc2nc(-c3ccccc3C(F)(F)F)c(cc12)S(C)(=O)=O
CNc1nc(N)nc2nc(c(cc12)C(O)=O)-c1ccccc1C(F)(F)F
CCCc1cc2c(NC)nc(N)nc2nc1-c1ccccc1C(F)(F)F
CNc1nc(N)nc2nc(c(C)cc12)-c1ccccc1C(F)(F)F
CNc1nc(N)nc2nc(ccc12)-c1c(F)cccc1N1CCCC1
CNc1nc(N)nc2nc(ccc12)-c1c(Cl)cccc1N1CCCC1
CNc1nc(N)nc2nc(ccc12)-c1c(cccc1C(F)(F)F)N1CCCC1
CNc1nc(N)nc2nc(ccc12)-c1c(cccc1C(F)(F)F)N1CCCCC1
CNc1nc(N)nc2nc(ccc12)-c1c(cccc1C(F)(F)F)N1CCOCC1
CNc1nc(N)nc2nc(ccc12)-c1c(Oc2ccccc2)cccc1C(F)(F)F
CNc1nc(N)nc2nc(ccc12)-c1c(SC)cccc1C(F)(F)F
CNc1nc(N)nc2nc(ccc12)-c1c(OC)cccc1C(F)(F)F
CNc1nc(N)nc2nc(ccc12)-c1c(F)cccc1C(F)(F)F
CNc1nc(N)nc2nc(ccc12)-c1c(Cl)cccc1Cl
CNc1nc(N)nc2nc(ccc12)-c1cc(Cl)ccc1Cl
CNc1nc(N)nc2nc(ccc12)-c1ccc(Cl)cc1Cl
CNc1nc(N)nc2nc(ccc12)-c1cccc(Cl)c1Cl
CNc1nc(N)nc2nc(ccc12)-c1ccccc1Cl
CNc1nc(N)nc2nc(ccc12)-c1ccccc1Br
CNc1nc(N)nc2nc(ccc12)-c1ccccc1C(O)=O
CNc1nc(N)nc2nc(ccc12)-c1ccccc1[N+]([O-])=O
CNc1nc(N)nc2nc(ccc12)-c1ccccc1OC
CNc1nc(N)nc2nc(ccc12)-c1ccccc1C
Nc1nc(NCCO)c2ccc(nc2n1)-c1ccccc1C(F)(F)F
CCCNc1nc(N)nc2nc(ccc12)-c1ccccc1C(F)(F)F
CCNc1nc(N)nc2nc(ccc12)-c1ccccc1C(F)(F)F
CNc1nc(N)nc2nc(ccc12)-c1ccccc1C(F)(F)F
OC(=O)C=Cc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(C=CC(O)=O)cc3)=NC2=O)cc1 |w:4.4,34.35,28.29,9.8,c:41,t:22|
O=C1N=C(NCCCCCCCNC2=NC(=O)C(S2)=Cc2ccccc2)SC1=Cc1ccccc1 |w:28.31,19.20,t:2,13|
Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)c(O)c3)=NC2=O)cc1O |w:5.4,24.25,c:34,t:18|
Oc1c(Br)cc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3cc(Br)c(O)c(Br)c3)=NC2=O)cc1Br |w:6.5,25.26,c:36,t:19|
Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:37,t:19|
Oc1ccc(C=C2SC(NCc3cccc(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)c3)=NC2=O)cc1 |w:5.4,24.25,c:35,t:18|
Oc1ccc(C=C2SC(NCC3CCCC(CNC4=NC(=O)C(S4)=Cc4ccc(O)cc4)C3)=NC2=O)cc1 |w:5.4,24.25,c:35,t:18|
Oc1ccc(C=C2SC(NCCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,26.27,c:35,t:20|
Oc1ccc(C=C2SC(NCCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,25.26,c:34,t:19|
Oc1ccc(C=C2SC(NCCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,24.25,c:33,t:18|
Oc1ccc(C=C2SC(NCCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,23.24,c:32,t:17|
Oc1ccc(C=C2SC(NCCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,22.23,c:31,t:16|
Oc1ccc(C=C2SC(NCCCCNC3=NC(=O)C(S3)=Cc3ccc(O)cc3)=NC2=O)cc1 |w:5.4,21.22,c:30,t:15|
[#6]\[#6](-[#6])=[#6]\[#6](=O)-[#6]C([#6])([#8])[#6@@H]-1-[#6]-[#6][C@@]([#6])([#8]-1)\[#6]=[#6]\[#6]C([#6])([#8])[#6]=[#6] |r|
OC(=O)CN1C(=S)S\C(=C/c2ccc(cc2)-c2ccc(OCc3ccccc3)cc2)C1=O
CCCCc1oc2ccccc2c1C
Cc1ccc2cc(O)ccc2c1
Cc1ccc(cc1)-c1ccc(OCC(O)=O)c(c1)-c1ccccc1
CCCCc1oc2ccccc2c1Cc1ccccc1
CCOc1ccccc1C
Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)COc1ccc(cc1Br)-c1ccccc1
CCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(OCC(O)=O)cc1
OC(=O)COc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
Cc1ccc(cc1)-c1ccc(O)c(C)c1
O=S(=O)(Oc1ccc(cc1)-c1ccccc1)c1ccccc1
Oc1ccc(cc1)-c1ccccc1
OC(=O)COc1ccc(cc1)-c1ccc(cc1)-c1ccsc1Cc1ccccc1
COc1ccc(cc1)-c1cc(ccc1OCC(O)=O)-c1ccc(C)cc1
Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Br)oc2ccccc12
OC(=O)[C@H](Cc1ccccc1)Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
COC(=O)[C@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
CCCC[C@@H](Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O
Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)[C@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccc(F)cc2)oc2ccccc12
Cc1oc(nc1-c1ccc(cc1)-c1ccc(O)cc1)-c1ccc(cc1)C(F)(F)F
Cc1oc(nc1-c1ccc2c(Br)c(OC(Cc3ccccc3)C(O)=O)ccc2c1)-c1ccc(cc1)C(F)(F)F
CCCc1cc(ccc1O[C@@H](Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)[C@@H](Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1nc2cccnc2n1Cc1ccccc1
COc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(O[C@H](Cc3ccccc3)C(O)=O)cc2)cc1OC |r|
OC(=O)C(Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1coc2ccccc12
Oc1ccc(cc1)-c1ccc(cc1)-c1coc2ccccc12
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12 |r|
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1nc2ccccc2n1Cc1ccccc1
CCCCc1oc2ccccc2c1-c1ccc(cc1)-c1ccc(OC)cc1
CCCCc1oc2ccccc2c1C(O)c1ccc2ccc(OCn3cnnn3)c(Br)c2c1
CCc1oc2ccccc2c1-c1ccc(cc1)-c1ccc(O)cc1
Cc1oc(nc1-c1cccc(c1)-c1ccc(OCC(O)=O)cc1)-c1ccc(cc1)C(F)(F)F
Cc1oc(nc1-c1cccc(c1)-c1ccc(O)cc1)-c1ccc(cc1)C(F)(F)F
OC(=O)[C@H](Cc1ccccc1)Oc1ccc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12
OC(=O)[C@H](Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)c1ccccc1 |r|
COc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(O[C@H](Cc3ccccc3)C(O)=O)cc2)c(OC)c1 |r|
CCCCc1oc2ccccc2c1Cc1ccc2ccc(O)cc2c1
CCCCc1oc2ccccc2c1C(=O)c1ccc2cc(O)ccc2c1
CCCCc1oc2ccccc2c1C(=O)c1ccc(cc1)-c1ccc(O)cc1
CCCCC(NC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)NC(=O)OC)C(=O)OC
OC(=O)c1cc(on1)-c1cccc(\C=C\COc2cccc(O)c2[N+]([O-])=O)c1
CCCCCn1c(O)c(Cc2ccc(Nc3ccccc3C(O)=O)c(CCC(N)=O)c2)n(C(=O)NC(C)C)c(=O)c1=O
OC(=O)C(=O)N(c1cc(Cl)ccc1C(O)=O)c1cccc2ccc(O)cc12
CCc1cc(CC(NC(C)=O)C(=O)NC(Cc2ccc(cc2)[N+]([O-])=O)C(=O)NC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(Cc2ccc(cc2)[N+]([O-])=O)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
OC(=O)C(=O)N(c1ccc2OCCOc2c1)c1ccccc1C(O)=O
CCC(C)C(NC(=O)CCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)NC(C)=O)C(O)=O
OCCc1ccccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CC(NC(=O)C(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(=O)OCC=C)c1ccc(cc1)[N+]([O-])=O
OC(=O)C(=O)N(c1ccccc1C(O)=O)c1c(O)ccc2ccccc12
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](CCCCN)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
COC(=O)c1c(O)cccc1OCCCCNC(=O)CCc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12
COC(=O)c1c(O)cccc1OCCn1ccc2ccc(cc12)-c1cc(no1)C(O)=O
OC(=O)C(=O)N(c1ccccc1Cc1ccccc1)c1ccccc1C(O)=O
OC(=O)C(=O)N(c1cc(ccc1C(O)=O)C#N)c1cccc2ccc(O)cc12
c1ccc(c(c1)C(=O)O)N(c2cccc3c2cc(cc3)O)C(=O)C(=O)O
COC(=O)c1c(O)cccc1OCC1CC1c1cccc(c1)-c1cc(no1)C(O)=O
CCCCCn1c(O)c(Cc2ccc(N(C(=O)C(O)=O)c3ccccc3C(O)=O)c(CC)c2)n(C(C)=O)c(=O)c1=O
COC(=O)c1c(O)cccc1OC(CO)\C=C\c1cccc(c1)-c1cc(no1)C(O)=O
CC(=O)NC(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(CCO)c1)C(=O)NCc1ccc(cc1)[N+]([O-])=O
OCC1CCN(CC1)c1ccccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
COC(=O)NC(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)C(=O)NCc1ccc(cc1)S(C)(=O)=O
CC(=O)N[C@@H](Cc1ccc(c(c1)O)OCC(=O)O)C(=O)NCCCCOc2cccc(c2C(=O)OC)O
COC(=O)c1c(O)cccc1OCCCC(=O)Nc1cccc(c1)-c1cc(no1)C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(CCSC)C(O)=O)ccc1N(C(=O)C(O)=O)c1cc(Cl)ccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(Cc2ccc(Cl)cc2)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
COCCC(CN(C(=O)C(O)=O)c1ccc(CC(NC(=O)OC(C)(C)C)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)cc1)C(O)=O
COC(=O)c1c(O)cccc1OC(CO)CCc1cc(ccc1F)-c1cc(no1)C(O)=O
CC(=O)N1CCC(CC1)C(=O)Nc1cccc(c1)-c1cc(no1)C(O)=O
CNC(=O)c1c(O)cccc1OC\C=C\c1cccc(c1)-c1cc(no1)C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(Cc2nccs2)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(Cc2cccs2)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
COC(=O)c1c(O)cccc1OCCCCCN1CCc2ccc(cc2C1)N(C(=O)C(O)=O)c1ccccc1C(O)=O
OC(=O)C(=O)N(c1cc(O)ccc1C(O)=O)c1cccc2ccc(O)cc12
CC(=O)NC(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)C(=O)NCCCN1CCCC1=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](Cc2ccccc2)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(Cc2ccc(O)cc2)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(C=CC(N)=O)c1)NC(=O)NC(C)C |w:30.30|
CCCCCNC(=O)C(Cc1ccc(N2CCCCC2)c(c1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(C)=O
Cn1ccc2c(cccc12)N(C(=O)C(O)=O)c1ccccc1C(O)=O
OC(=O)c1ccc(O)cc1-n1c2ccccc2oc(=O)c1=O |(-2.07,1.5,;-1.48,.92,;-1.77,.15,;-.71,1.2,;-.57,2.02,;.21,2.3,;.84,1.77,;1.62,2.05,;.7,.95,;-.08,.67,;-.08,-.65,;.64,-1.06,;1.35,-.65,;2.07,-1.06,;2.07,-1.88,;1.35,-2.3,;.64,-1.88,;-.08,-2.3,;-.79,-1.88,;-1.51,-2.3,;-.79,-1.06,;-1.8,-.69,)|
COC(=O)c1c(O)cccc1OCCCCNC(=O)C(Cc1ccc(cc1)N(CC(Cc1ccccc1)C(O)=O)C(=O)C(O)=O)NC(=O)OC(C)(C)C
COC(=O)c1c(O)cccc1OCCOCCNC(=O)C(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(=O)OCC=C
Nc1c(noc1-c1ccccc1)C(O)=O
OC(=O)C(=O)N(c1cc(ccc1C(O)=O)[N+]([O-])=O)c1cccc2ccc(O)cc12
COC(=O)c1c(O)cccc1OCCCCNCCCc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12
CC(C)(C)OC(=O)Nc1ccc(O)c(c1)-c1cc(no1)C(O)=O
COC(=O)NC(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)C(=O)NCCCCOc1cc(OC(C)C)cc(O)c1C(=O)OC
OCc1c(noc1-c1cccc(I)c1)C(O)=O
CC(=O)NC(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(CCO)c1)C(O)=O
CCCCCNCc1cccc(c1)-c1cc(no1)C(O)=O
Nc1ccc(cc1)-c1cc(no1)C(O)=O
COC(=O)c1c(O)cccc1OC\C=C\c1ccc2CCc3c(noc3-c2c1)C(O)=O
CCC(C)C(NC(=O)CCCCNC(=O)C(Cc1ccc(NC(=O)C(O)=O)c(c1)C(O)=O)NC(C)=O)C(O)=O
COC(=O)NC(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)C(=O)NCCCCOc1cc(cc(O)c1C(=O)OC)-c1ccccc1
COC(=O)c1c(O)cccc1OCCNc1cccc(c1)-c1cc(no1)C(O)=O
CCCCCCNC(=O)Nc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12
OC(=O)\C=N\OCc1ccccc1
COC(=O)c1c(O)cccc1OCCCCNC(C)CCc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12
OC\C=C\c1ccccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCC(C)C(NC(=O)CCCCNC(=O)C(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(C)=O)C(O)=O
CCCCCNC(=O)C(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(=O)C(Cc1ccc(cc1)C(=O)c1ccccc1)NC(=O)OC(C)(C)C
OC(=O)c1nc2ccccc2s1
CN(C1CCC(CC1)C(O)=O)C(=O)C(Cc1ccc(cc1)N(C(=O)C(O)=O)c1ccccc1C(O)=O)NC(=O)OC(C)(C)C
OCC1CCCN(C1)c1ccccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
NC(=O)c1ccc2cccc(N(C(=O)C(O)=O)c3ccccc3C(O)=O)c2c1
CCCC(=O)Nc1cc(ccc1NC(C)=O)-c1cc(no1)C(O)=O
OC(=O)C(=O)N(c1cccc2CCCCc12)c1ccccc1C(O)=O
CC(C)(C)OC(=O)Nc1cccc(c1)-c1cc(no1)C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](CCS(C)(=O)=O)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(C(O)=O)c2c[nH]c3ccccc23)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
OC(=O)c1cc(on1)-c1cccc(c1)-c1cccc(c1)-c1cc(no1)C(O)=O
CC(=O)NC(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)C(=O)NCCO
OC(=O)C(=O)N(c1ccccc1N1CCCCC1)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N2CCCC2C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC(CSCc2ccccc2)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCc1ccccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
OC(=O)C(=O)N(c1ccccc1C(O)=O)c1cc(cc2ccccc12)[N+]([O-])=O
OC(=O)C(=O)N(c1ccc2ccccc2c1)c1ccccc1C(O)=O
CCCC[C@H](NC(=O)CCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(CC)c1)NC(C)=O)C(O)=O |r|
COC(=O)c1cc2ccccc2c(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c1O
CCCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(C=CC(N)=O)c1)NC(=O)OC(C)(C)C |w:30.30|
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)N[C@@H](CCC(N)=O)C(O)=O)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O |r|
OCCNc1ccccc1-c1cc(no1)C(O)=O
CCc1cc(CC(NC(C)=O)C(=O)NCCCCC(=O)NC2CCCCC2)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
COc1cccc(c1)N(C(=O)C(O)=O)c1ccccc1C(O)=O
CCSCC[C@H](NC(=O)CCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(CC)c1)NC(C)=O)C(O)=O |r|
CCCCCNC(=O)C(Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c(\C=C\C(N)=O)c1)NC(=O)C(Cc1ccccc1)NC(=O)CCC(O)=O
COc1ccc2CCc3c(noc3-c2c1)C(O)=O
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1-c1ccc(Cl)cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12 |r|
OC(=O)[C@H](CCc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12 |r|
CCCCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(O[C@H](Cc2ccccc2)C(O)=O)cc1 |r|
CCCCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(O[C@@H](C(O)=O)c2ccccc2)cc1 |r|
OC(c1oc2ccccc2c1-c1ccc(cc1)-c1ccc(O[C@H](Cc2ccccc2)C(O)=O)cc1)c1ccccc1 |r|
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccc(F)cc2)sc2ccccc12 |r|
COc1ccc(Cc2sc3ccccc3c2-c2ccc(cc2)-c2ccc(O[C@H](Cc3ccccc3)C(O)=O)cc2)cc1 |r|
C[C@@H](Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O |r|
OC(=O)[C@H](CCc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
COc1ccc(cc1)-c1cc(ccc1O[C@@H](Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1[N+]([O-])=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
Cc1cc(cc(C)c1O[C@H](Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
OC(=O)[C@H](Cc1ccccc1)Oc1ccc(cc1C1CCCC1)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
OC(=O)[C@@H](Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12 |r|
OC(=O)[C@H](Cc1ccccc1)Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12 |r|
CC[C@H](Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O |r|
OC(=O)\C=C\C(=O)Nc1cc(ccc1O)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12
COc1ccc(cc1)-c1cc(ccc1O[C@H](Cc1ccccc1)C(O)=O)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12 |r|
CCCCc1sc2ccccc2c1-c1ccc(cc1)-c1ccc(OCC(O)=O)cc1
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(oc2ccccc12)C(=O)c1ccccc1 |r|
CC(C)C[C@@H](Oc1c(Br)cc(cc1Br)-c1ccc(cc1)-c1c(Cc2ccccc2)oc2ccccc12)C(O)=O |r|
OC(=O)[C@H](Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccc(O)cc2O)sc2ccccc12)c1ccccc1 |r|
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-c1ccc(cc1)-c1c(Cc2ccccc2)sc2ccccc12 |r|
[#6]\[#6](-[#6])=[#6]-1\[#6]-[#6]=[#6](-[#6@H]-2-[#6]-[#6][C@]3([#6])[#6@@H]-2-[#6]-[#6]-[#6@@H]2[C@@]4([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]4-[#6]-[#6][C@@]32[#6])-[#6]-1=O |r,t:5|
[#6]\[#6](-[#6])=[#6]-1\[#6]-[#6](=[#6]-[#6]-1=O)-[#6@H]-1-[#6]-[#6][C@]2([#6])[#6@@H]-1-[#6]-[#6]-[#6@@H]1-[#6]-3=[#6](-[#6]-[#6][C@@]21[#6])C([#6])([#6])[#6@@H]-1-[#6]-[#6]-[#6@H]-3-[#8]-1 |r,c:5,20|
[#6]\[#6](-[#6])=[#6]-1\[#6]-[#6]=[#6](-[#6@H]-2-[#6]-[#6][C@]3([#6])[#6@@H]-2-[#6]-[#6]-[#6@@H]2-[#6]-4=[#6](-[#6]-[#6][C@@]32[#6])C([#6])([#6])[#6@@H]-2-[#6]-[#6]-[#6@H]-4-[#8]-2)-[#6]-1=O |r,c:17,t:5|
C[C@@]12CC[C@@H]([C@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C)C(O)=O |r|
[#6]\[#6](-[#6])=[#6]/[#6@H]-1-[#6][C@@]([#8])([#6@H]-2-[#6]-[#6][C@]3([#6])[#6@@H]-2-[#6]-[#6]-[#6@@H]2[C@@]4([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]4-[#6]-[#6][C@@]32[#6])[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]/[#6@@H]-1-[#6][C@]([#8])([#6@H]-2-[#6]-[#6][C@]3([#6])[#6@@H]-2-[#6]-[#6]-[#6@@H]2[C@@]4([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]4-[#6]-[#6][C@@]32[#6])[#6](=O)-[#8]1 |r|
[#6]\[#6](-[#6])=[#6]\[#6@@H]-1-[#8]-[#6](=O)-[#6](=[#6]1)-[#6@H]-1-[#6]-[#6][C@]2([#6])[#6@@H]-1-[#6]-[#6]-[#6@@H]1[C@@]3([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]3-[#6]-[#6][C@@]21[#6] |r,c:8|
CC(=C)[C@@H](O)CC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C |r|
CC(=C)CCC[C@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C |r|
C\C(=C\CCC(C)(C)O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C |r|
[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@]([#6])([#8])[#6@H]-1-[#6]-[#6][C@]2([#6])[#6@@H]-1-[#6@H](-[#8])-[#6]-[#6@@H]1[C@@]3([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]3-[#6]-[#6][C@@]21[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-[#6][C@@]([#8])([#6]-[#8])[#6@H]-1-[#6]-[#6][C@]2([#6])[#6@@H]-1-[#6]-[#6]-[#6@@H]1[C@@]3([#6])[#6]-[#6]-[#6@H](-[#8])C([#6])([#6])[#6@@H]3-[#6]-[#6][C@@]21[#6] |r|
CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@]3(C)[C@@H]2CC[C@@H]2[C@H](CC[C@@]32C)C2=C[C@H](CC(C)(C)O)OC2=O)C1(C)C |r,t:26|
CC(C)(O)C[C@H]1OC(=O)C(=C1)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C |r,c:9|
CC(C)(O)C[C@@H]1OC(=O)C(=C1)[C@H]1CC[C@]2(C)[C@@H]1CC[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C |r,c:9|
OC(=O)c1cc2c(CCc3ccc(Oc4ccccc4)cc3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(CCc3ccc(OC(F)(F)F)cc3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(CCc3cccc(c3)C(F)(F)F)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(CCc3cccc(F)c3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(\C=C/c3ccc(OC(F)(F)F)cc3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(\C=C/c3cc(F)cc(F)c3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#C)c(oc2cc1O)-c1ccccc1
C[C@]12CC[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C#Cc1c(oc2cc(O)c(cc12)C(O)=O)-c1ccccc1 |r,t:8|
OCC#Cc1c(oc2cc(O)c(cc12)C(O)=O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3ccccc3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3cccc(F)c3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3cccc(Cl)c3)c(oc2cc1O)-c1ccccc1
COc1cccc(c1)C#Cc1c(oc2cc(O)c(cc12)C(O)=O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3ccc(F)cc3F)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3cc(F)cc(F)c3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3cccc(c3)C(F)(F)F)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3ccc(OC(F)(F)F)cc3)c(oc2cc1O)-c1ccccc1
OC(=O)c1cc2c(C#Cc3ccc(Oc4ccccc4)cc3)c(oc2cc1O)-c1ccccc1
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C |r,t:16|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4[C@H](C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C |r|
CC(C)C(=C)CC[C@@H](C)[C@H]1CC[C@@H]2[C@]1(C)CC[C@@H]1[C@@]3(C)CC[C@H](OC(C)=O)[C@@H](C)[C@@H]3CC[C@@]21O |r|
CC(=O)C=C[C@H]1C(=C)CC[C@H]2C(C)(C)CCC[C@]12C |r,w:3.2|
CC1(C)CCC[C@]2(C)[C@@H](C\C=C(\CC(O)=O)C=O)C(=C)CC[C@@H]12 |r|
[#6]\[#6](-[#6])=[#6]-1/[#6]-[#6@@H]2[C@@]([#6])([#8])[#6]-[#6][C@]2([#8])[#6](-[#6])=[#6]-[#6]-1=O |r,c:15|
[#6]\[#6](-[#6])=[#6]-1/[#6]-[#6@H]2-[#6@@H](-[#6]-[#6][C@]2([#6])[#8])-[#6](-[#6])=[#6]-[#6]-1=O |r,c:14|
[#6]\[#6](-[#6])=[#6]-1/[#6]-[#6@H]2-[#6@@H](-[#6]-[#6][C@@]2([#6])[#8])[C@@]([#6])([#8])[#6]-[#6]-1=O |r|
[#6]\[#6](-[#6])=[#6]-1/[#6]-[#6@@H](-[#8])[C@@]([#6])([#8])[#6]-[#6]-[#6@@H](-[#8])-[#6](-[#6])=[#6]-[#6]-1=O |r,w:16.16|
[#6]\[#6](-[#6])=[#6]-1/[#6]-[#6@@H](-[#8])[C@@]([#6])([#8])[#6]-[#6]-[#6@H](-[#8])-[#6](-[#6])=[#6]-[#6]-1=O |r,w:16.16|
CC1=C[C@@H]2CC(C)(C)[C@H]1\C=C/c1ccoc21 |r,c:10,t:1|
COc1ccc(cc1)C(=O)CCc1ccc(cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
O=C(Nc1ccc(cc1)S(=O)(=O)Nc1nccs1)c1ccc(\C=C\C(=O)c2ccc(cc2)C#N)cc1
Cc1ccc(cc1)C(=O)\C=C\c1ccc(cc1)C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nccs1
O[V](=O)([O-])[O-]
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)NC(=O)c2ccc(Cl)cc2)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)NC(=O)c2ccccc2)cc1
CC(=O)NS(=O)(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)c1nc2ccccc2o1
CC(C)Oc1ccc(NS(=O)(=O)C(Cc2ccc(NC(=O)C(O)=O)cc2)c2nc3ccccc3o2)cc1
COc1ccc(NS(=O)(=O)C(Cc2ccc(NC(=O)C(O)=O)cc2)c2nc3ccccc3o2)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Cc1ccc(NS(=O)(=O)C(Cc2ccc(NC(=O)C(O)=O)cc2)c2nc3ccccc3o2)cc1
OC(=O)CN(CC(O)=O)S(=O)(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)c1nc2ccccc2o1
CC(C)(C)c1ccc(CN(Cc2ccc(cc2)C(C)(C)C)S(=O)(=O)C(Cc2ccc(NC(=O)C(O)=O)cc2)c2nc3ccccc3o2)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)N(Cc2ccc(OC(F)(F)F)cc2)Cc2ccc(OC(F)(F)F)cc2)cc1
COc1ccc(CN(Cc2ccc(OC)cc2)S(=O)(=O)C(Cc2ccc(NC(=O)C(O)=O)cc2)c2nc3ccccc3o2)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)N(Cc2ccc(cc2)C(F)(F)F)Cc2ccc(cc2)C(F)(F)F)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)N(Cc2cccc(c2)C(F)(F)F)Cc2cccc(c2)C(F)(F)F)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)N(Cc2ccccc2C(F)(F)F)Cc2ccccc2C(F)(F)F)cc1
OC(=O)C(=O)Nc1ccc(C[C@H](c2nc3ccccc3o2)S(=O)(=O)N(Cc2ccc(Cl)cc2)Cc2ccc(Cl)cc2)cc1 |r|
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)N(Cc2ccc(F)cc2)Cc2ccc(F)cc2)cc1
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)NCCc2ccc(Cl)cc2)cc1
CCCCNS(=O)(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)c1nc2ccccc2o1
CC(C)(C)NS(=O)(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)c1nc2ccccc2o1
NS(=O)(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)c1nc2ccccc2o1
CN(c1ccc(F)cc1)S(=O)(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)c1nc2ccccc2[nH]1
OC(=O)C(=O)Nc1ccc(C[C@H](c2nc3ccccc3o2)S(=O)(=O)Nc2ccc(F)cc2)cc1 |r|
OC(=O)COc1ccc(CC(c2nc3ccccc3o2)S(=O)(=O)Nc2ccc(F)cc2)cc1O
Oc1ccc(CC(c2nc3ccccc3[nH]2)S(=O)(=O)Nc2ccc(F)cc2)cc1O
OC(=O)C(=O)Nc1ccc(CC(c2nc3ccccc3[nH]2)S(=O)(=O)Nc2ccc(F)cc2)cc1
OC(=O)COc1ccc(CC(c2nc3ccccc3[nH]2)S(=O)(=O)Nc2ccc(F)cc2)cc1O
OC(=O)c1ccc(CC(c2nc3ccccc3[nH]2)S(=O)(=O)Nc2ccc(F)cc2)cc1
COC(=O)c1c(O)cccc1OCCCCNC(=O)C(Cc1ccc(NC(=O)C(O)=O)cc1)NC(C)=O
CCc1cc(CN(C(C)=O)C(=O)NCCCCOc2cccc(O)c2C(=O)OC)ccc1N(C(=O)C(O)=O)c1ccccc1C(O)=O
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@H]6O[C@@H]([C@@H](O)[C@H](O)[C@@H]6O)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCCCCCC(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)C(O)=O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCCCCCC(O)=O |r,c:10|
CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@H](O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)NCCCCCC(O)=O |r,c:10|
COC(=O)CCCCCNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O)C(=O)OC)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 |r,t:21|
COC(=O)CCCCCNC(=O)[C@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O[C@H]5O[C@@H]([C@@H](O)[C@H](O)[C@@H]5O)C(O)=O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2 |r,t:21|
CC(C)COCc1cc(O)c(O)c(Br)c1Cc1cc(O)c(O)c(Br)c1Br
CCCOCc1cc(O)c(O)c(Br)c1Cc1cc(O)c(O)c(Br)c1Br
Oc1cc(Cc2cc(Br)c(O)c(Br)c2Br)c(Br)c(Br)c1O
c1cc(cc(c1)Cl)C#Cc2c3cc(c(cc3oc2c4ccc(cc4)OCC(=O)NC5CC5)O)C(=O)O
CCCNC(=O)COc1ccc(cc1)-c1oc2cc(O)c(cc2c1C#Cc1cccc(Cl)c1)C(O)=O
COC(=O)C1=CC=C(CCC2=CCC[C@](C)(OC2=O)C(=O)CC1)C(C)C |r,w:5.5,7.24,t:10|
CC(C)C1=C/C=C(C)\CCC(=O)[C@]2(C)CCC=C(CC\1)C(=O)O2 |r,t:3,5,16|
COC(=O)C1=CC=C(CCC2=CCC[C@](C)(OC2=O)C(=O)CC1)C(C)C |r,w:6.5,4.23,t:10|
CC(C)C1=C/C=C(C)/CC\C=C(C)\CC\C=C(C)\CC\1 |c:5,10,15,t:3|
COC(=O)C1=C\C=C(/CC\C(C)=C\CC\C(C)=C\CC\1)C(C)C |c:4,6,t:11,16|
Brc1ccc(CC(=O)OC2CSS(=O)C2)cc1
O=C(OC1CSS(=O)C1)c1cc2ccccc2[nH]1
Brc1ccc(Br)c(c1)C(=O)OC1CSS(=O)C1
Ic1ccccc1C(=O)OC1CSS(=O)C1
Ic1ccc(cc1)C(=O)OC1CSS(=O)C1
Brc1cccc(c1)C(=O)OC1CSS(=O)C1
Brc1cccc(c1)C(=O)OC1CSS(=O)(=O)C1
O=C(OC1CSSC1)c1cc2ccccc2[nH]1
O=C(OC1CSSC1)c1ccco1
O=C(OC1CSSC1)c1ccoc1
[O-][N+](=O)c1ccc(cc1)C(=O)OC1CSSC1
NS(=O)(=O)c1ccc(cc1)C(=O)OC1CSSC1
Brc1ccc(Br)c(c1)C(=O)OC1CSSC1
Ic1ccccc1C(=O)OC1CSSC1
Ic1ccc(cc1)C(=O)OC1CSSC1
Brc1ccc(cc1)C(=O)OC1CSSC1
O[C@@H]1CSS(=O)(=O)C1 |r|
[O-][N+](=O)c1cc(cc(c1)[N+]([O-])=O)C(=O)OC1CSSC1
COC(=O)c1cccc(c1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
N=c1c(C#N)c2CCOCc2nn1-c1ccccc1
CC1(C)Cc2c(CO1)nn(-c1ccccc1)c(=N)c2C#N
CCOc1ccccc1-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CCOc1ccc(cc1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC1(C)Cc2c(CO1)nn(-c1cccc(c1)C(F)(F)F)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccccc1C(F)(F)F)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1cccc(CO)c1)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccccc1CO)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccc(CO)cc1)c(=N)c2C#N
CCc1cccc(c1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CCc1ccccc1-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CCc1ccc(cc1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC1(C)[CH-]c2c(CO1)nn(-c1ccccc1[N+]([O-])=O)c(=[NH2+])c2C#N
CC(=O)Nc1cccc(c1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC(=O)Nc1ccc(cc1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC1(C)Cc2c(CO1)nn(-c1cccc(Oc3ccccc3)c1)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccccc1Oc1ccccc1)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccc(Oc3ccccc3)cc1)c(=N)c2C#N
COc1cccc(c1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
COc1ccccc1-n1nc2COC(C)(C)Cc2c(C#N)c1=N
COc1ccc(cc1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC1(C)Cc2c(CO1)nn(-c1ccc(CCO)cc1)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1cccc(F)c1)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccccc1F)c(=N)c2C#N
CC1(C)Cc2c(CO1)nn(-c1ccc(F)cc1)c(=N)c2C#N
CCCCc1ccccc1-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CCCCc1ccc(cc1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC(C)c1cccc(c1)-n1nc2COC(C)(C)Cc2c(C#N)c1=N
CC1(C)Cc2c(CO1)nn(-c1ccccc1N1CCOCC1)c(=N)c2C#N
N=c1c(C#N)c2CCSCc2nn1-c1ccccc1
COc1ccc(cc1)-n1nc2CSCCc2c(C#N)c1=N
Fc1ccccc1-n1nc2CSCCc2c(C#N)c1=N
Fc1ccc(cc1)-n1nc2CSCCc2c(C#N)c1=N
CC(C)c1ccccc1-n1nc2CSCCc2c(C#N)c1=N
CC(C)c1ccc(cc1)-n1nc2CSCCc2c(C#N)c1=N
N=c1c(C#N)c2CCCCc2nn1-c1ccccc1
FC(F)(F)c1ccc(cc1)-n1cc(COc2ccc(cc2)-c2nc3c(ccc4ccccc34)o2)nn1
Cc1ccc(cc1)-n1cc(COc2ccc(cc2)-c2nc3c(ccc4ccccc34)o2)nn1
CCN1\C(Sc2ccccc12)=C1\SC(=S)N(CC=C)C1=O
CCCOc1c2Cc3cccc(Cc4cccc(Cc5cc(cc(Cc1ccc2)c5O)C(P(O)(O)=O)P(O)(O)=O)c4OCCC)c3O
CCCOc1c2Cc3cccc(Cc4cccc(Cc5cc(cc(Cc1ccc2)c5O)C(O)(P(O)(O)=O)P(O)(O)=O)c4OCCC)c3O
CCCOc1c2Cc3cc(cc(Cc4cccc(Cc5cc(cc(Cc1ccc2)c5O)C(O)(P(O)(O)=O)P(O)(O)=O)c4OCCC)c3O)C(O)(P(O)(O)=O)P(O)(O)=O
CCCOc1c2Cc3cc(cc(Cc4cccc(Cc5cc(cc(Cc1ccc2)c5O)C(P(O)(O)=O)P(O)(O)=O)c4OCCC)c3O)C(P(O)(O)=O)P(O)(O)=O
COc1c(O)c(O)ccc1[C@@H]1C(C(=O)c2ccc(O)cc2)=C(Cc2cc(O)c(O)c(OC)c12)C(=O)c1ccc(O)cc1 |r,c:22|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(-[#6]-[#6@@H](-[#8])-[#6](=O)-c2cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8])ccc1-[#8] |r|
CC1(C)Oc2ccc(c(O)c2C=C1)-c1coc2cc(O)ccc2c1=O |c:12|
COc1ccc(cc1O)-c1coc2cc(O)c(OC)cc2c1=O
[#6]\[#6](-[#6])=[#6]/[#6]-c1cc(ccc1-[#8])-[#6@H]-1-[#8]-c2c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])ccc2-[#6](-[#8])-[#6]-1=O |r|
[#6]\[#6](-[#6])=[#6]/[#6]-c1c(-[#8])ccc2-[#6](=O)-[#6]-[#6@H](-[#8]-c12)-c1ccc2-[#8]C([#6])([#6])[#6](-[#8])-[#6]-c2c1 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])-[#6](=O)-[#6]-[#6](=O)-c1cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc1-[#8]
CC1(C)Oc2ccc(\C=C\C(=O)c3ccc(O)cc3O)cc2C=C1 |c:24|
CC1(C)Oc2ccc(C(=O)\C=C\c3ccc(O)cc3)c(O)c2C=C1 |c:24|
[#6]-[#8]-c1c(\[#6]=[#6]\[#6](=O)-c2ccc(-[#8])c(-[#8])c2)ccc(-[#8])c1-[#6]\[#6]=[#6](/[#6])-[#6]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1c2-[#8]\[#6](=[#6]/c3ccc(-[#8])c(-[#8])c3)-[#6](=O)-c2ccc1-[#8]
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc(ccc1-[#8])[C@@]12[#8][C@@]34[#6@@H](-[#8]-c5c3ccc(-[#8])c5-[#6]\[#6]=[#6](\[#6])-[#6])-[#8]-c3cc(-[#8])ccc3-[#6@@H]4-[#6@@H]1-[#6](=O)-c1cc(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc1-[#8]2 |r|
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2-[#6](=O)C([#8]-c2cc1-[#8])([#6](=O)-c1ccc(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c1)c1cc(-[#8])c(-[#8])cc1\[#6]=[#6]-1/[#8]-c2c(ccc(-[#8])c2-[#6]\[#6]=[#6](/[#6])-[#6])-[#6]-1=O
COC(=O)c1cccc(NC(=O)c2csc(n2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)C2CCCCC2)c1 |r|
COC(=O)c1ccccc1NC(=O)c1csc(n1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
C\C(\C=C(\C)C(O)=O)=C/c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
CCOC(=O)C(\C)=C/C(/C)=C/c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
CCOC(=O)C(\C)=C/C(/C)=C/c1nc(sc1CC(C)C)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
CCOC(=O)C(\C)=C/C(/C)=C/c1nc(sc1C)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
C\C(\C=C(\C)C(O)=O)=C/c1csc(n1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
CCOC(=O)C(\C)=C/C(/C)=C/c1csc(n1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
OC(=O)c1ccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)cc1F |r|
OC(=O)c1ccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)c(F)c1 |r|
OC(=O)c1ccc(F)c(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)c1 |r|
OC(=O)c1cc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)ccc1Cl |r|
OC(=O)c1cc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)ccc1F |r|
OC(=O)c1ccc(Br)cc1NC(=O)c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CCc1c[nH]c2ccccc12 |r|
OC(=O)c1ccc(Cl)cc1NC(=O)c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CCc1c[nH]c2ccccc12 |r|
OC(=O)c1ccc(F)cc1NC(=O)c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CCc1c[nH]c2ccccc12 |r|
OC(=O)c1cc(F)ccc1NC(=O)c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CCc1c[nH]c2ccccc12 |r|
OC(=O)c1c(F)cccc1NC(=O)c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CCc1c[nH]c2ccccc12 |r|
OC(=O)c1ccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)cc1 |r|
OC(=O)c1ccccc1NC(=O)c1nc(sc1-c1ccccc1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)CCc1c[nH]c2ccccc12 |r|
OC(=O)c1cccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)c1 |r|
COC(=O)c1cccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)CCc2c[nH]c3ccccc23)c1 |r|
OC(=O)c1cccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)C2CCCCC2)c1 |r|
COC(=O)c1cccc(NC(=O)c2nc(sc2-c2ccccc2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)C2CCCCC2)c1 |r|
OC(=O)c1ccc(NC(=O)c2csc(n2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)C2CCCCC2)cc1 |r|
OC(=O)c1cccc(NC(=O)c2csc(n2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)C2CCCCC2)c1 |r|
OC(=O)c1ccccc1NC(=O)c1csc(n1)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)C1CCCCC1 |r|
COC(=O)c1ccc(NC(=O)c2csc(n2)[C@H](Cc2ccc(OCc3ccccc3)cc2)NC(=O)C2CCCCC2)cc1 |r|
OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(CN(Cc2ccccc2)c2ccccc2)cc1 |r|
OC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc(CN(Cc2ccccc2)Cc2ccccc2)cc1 |r|
OC(=O)CN(C(=O)Cc1ccccc1)c1ccc(CN(Cc2ccc3OCOc3c2)c2ccc(F)cc2)cc1
OC(=O)CC(CC(=O)c1ccccc1)c1ccc(Cn2c3ccccc3c3ccccc23)cc1
OC(=O)CC(CC(=O)c1ccccc1)c1ccc(cc1)-n1c2ccccc2c2ccccc12
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(CN(Cc2ccc3OCOc3c2)c2ccc(F)cc2)cc1 |r|
OC(=O)[C@@H](Cc1ccccc1)Oc1ccc(cc1)-n1c2ccccc2c2ccccc12 |r|
COc1cc(cc(OC)c1OC)-c1nnc(SCC(=O)Nc2cc(ccc2C)C(O)=O)o1
Cc1ccc(cc1)-c1nnc(SCC(=O)Nc2cc(ccc2C)C(O)=O)o1
Cc1ccc(cc1NC(=O)CSc1nnc(o1)-c1ccc(O)cc1)C(O)=O
Cc1ccc(cc1NC(=O)CSc1nc2ccccc2s1)C(O)=O
COc1ccc2nc(SCC(=O)Nc3cc(ccc3C)C(O)=O)[nH]c2c1
Cc1ccc(cc1NC(=O)CSc1nc2ccccc2[nH]1)C(O)=O
OC[C@@H]1Oc2cc(\C=C\C(O)=O)ccc2O[C@@H]1c1ccc(O)c(O)c1 |r|
OC[C@@H]1Oc2cc(\C=C\C(O)=O)ccc2O[C@H]1c1ccc(O)c(O)c1 |r|
COc1cc(ccc1O)[C@H]1Oc2ccc(CCCO)cc2O[C@@H]1CO |r|
COc1cc(ccc1O)[C@H]1Oc2ccc(\C=C\C(O)=O)cc2O[C@@H]1CO |r|
COc1cc(ccc1O)[C@H]1Oc2ccc(cc2O[C@@H]1CO)C(O)=O |r|
COc1cc(cc(OC)c1OC)[C@H]1OC[C@H]2[C@@H]1CO[C@@H]2c1cc(OC)c(OC)c(OC)c1 |r|
COc1cc(cc(OC)c1O)[C@H]1OC[C@H]2[C@@H]1CO[C@@H]2c1cc(OC)c(O)c(OC)c1 |r|
COc1cc(ccc1O)[C@@H]1OC[C@H]2[C@@H]1CO[C@H]2c1ccc(O)c(OC)c1 |r|
Oc1ccc(cc1O)[C@@H]1OC[C@@H]2[C@H]1CO[C@H]2c1ccc(O)c(O)c1
Oc1ccc(cc1O)[C@H]1OC[C@H]2[C@@H]1CO[C@H]2c1ccc(O)c(O)c1 |r|
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3ccc(OCCc4ccccc4)cc3)C2=O)cc1
COc1cc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1OCCc1ccccc1
COc1ccc(\C=C2/S\C(=N/c3ccccc3)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1OCCc1ccccc1
COc1cc(\C=C2/S\C(=N/c3ccccc3)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1OCCc1ccccc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3ccc(OCCc4ccccc4)cc3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccccc2)=C\c2ccc(OCc3ccccc3)c(F)c2)cc1
COc1cc(\C=C2/S\C(=N/c3ccccc3)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1OCc1ccccc1
COc1ccc(\C=C2/S\C(=N/c3ccccc3)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1OCc1ccccc1
OC(=O)c1ccc(CN2\C(S\C(=C/c3cccc(OCCc4ccccc4)c3)C2=O)=N\c2ccccc2)cc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3ccc(OCc4ccccc4)c(F)c3)C2=O)cc1
COc1cc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)ccc1OCc1ccccc1
COc1ccc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1OCc1ccccc1
COc1ccc(\C=C2/SC(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1OCCc1ccccc1
OC(=O)c1ccc(CN2C(=O)S\C(=C/c3cccc(OCCc4ccccc4)c3)C2=O)cc1
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r,t:18|
[H][C@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)OC[C@@H](O)[C@H](O)[C@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)OC[C@H](O)[C@H](O)[C@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@H](CO)[C@@H](O[C@]2([H])O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@H](CO)[C@@H](O[C@]2([H])O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O |r,t:18|
[H][C@@]1(O[C@H]2CC[C@@]3(C)[C@@]([H])(CC[C@]4(C)[C@]3([H])CC=C3[C@]5([H])CC(C)(C)CC[C@@]5(CC[C@@]43C)C(=O)O[C@@H]3O[C@H](CNC(=O)c4ccccc4C(O)=O)[C@@H](O)[C@H](O)[C@H]3O)C2(C)C)O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O |r,t:18|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(=O)O[C@@H]1O[C@H](CNC(=O)c2ccccc2C(O)=O)[C@@H](O)[C@H](O)[C@H]1O |r,t:15|
CC(C)C1=CC2=C3C(C[C@@]2(C)CC1=O)=NC(C)(C)C=C3C |r,c:15,20,t:3,5|
CC(C)C1=C2C=C3C(C)=CC(C)(C)N=C3C[C@@]2(C)CC1=O |r,c:3,8,13,t:5|
CC(C)[C@@]12CC(=O)C(C)=C1C=C1C(C)=CC(C)(C)N=C1C2 |r,c:8,14,19,t:11|
CC1=CC(C)(C)N=C2C[C@]3(C)C(=O)C(C)(C)N=C3C(C)=C12 |r,c:16,t:1,6,20|
[H][C@]12[C@@H](OC)[C@H](OC(=O)C(\C)=C/C)\C(CO)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:15|
[H][C@]12[C@@H](OC)[C@H](OC(=O)c3ccccc3)\C(CO)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:18|
[H][C@]12[C@@H](OC)[C@H](OC(=O)C(\C)=C/C)\C(C=O)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:15|
[H][C@]12[C@@H](OC)[C@H](OC(=O)[C@]3(C)O[C@@H]3C)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:16|
[H][C@]12[C@@H](OC)[C@H](OC(=O)[C@@]3(C)O[C@@H]3C)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:16|
[H][C@]12[C@@H](OC)[C@H](OC(C)=O)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(=O)[C@@]3(C)C[C@H]3C)[C@@]1([H])C2(C)C |r,t:11|
[H][C@]12[C@@H](OC)[C@H](OC(=O)C(=C)C(C)O)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:15|
[H][C@@]12[C@@H](O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](OC(=O)c3ccccc3)[C@H](OC)[C@]1([H])C2(C)C |r,c:21|
[H][C@]12[C@@H](OC)[C@H](OC(=O)c3ccccc3)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:17|
[H][C@@]12[C@@H](O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](O)[C@@]3(O4)\C=C(C)\[C@@H](OC(=O)C(\C)=C/C)[C@H](OC)[C@]1([H])C2(C)C |r,c:18|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(=O)[C@@]5(C)C[C@H]5C)[C@@]3(O4)\C=C(C)\[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@]1([H])C2(C)C |r,c:29|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](OC(C)=O)[C@H](OC(=O)[C@@]3(C)C[C@H]3C)[C@]1([H])C2(C)C |r,c:24|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](O)[C@H](OC(=O)C(C)CC)[C@]1([H])C2(C)C |r,c:24|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](O)[C@@]3(O4)\C=C(C)\[C@@H](OC(C)=O)[C@H](OC(=O)C(C)CC)[C@]1([H])C2(C)C |r,c:21|
[H][C@@]12[C@@H](O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](O)[C@H](OC(=O)c3ccccc3)[C@]1([H])C2(C)C |r,c:21|
[H][C@@]12[C@@H](O)[C@@H](C)C(=O)[C@@]34C[C@@H](C)[C@@H](O)[C@@]3(O4)\C=C(C)\[C@@H](OC(=O)C(\C)=C/C)[C@H](OC)[C@]1([H])C2(C)C |r,c:18|
[H][C@]12[C@@H](OC)[C@H](OC(=O)C(\C)=C/C)\C(C)=C\[C@@]34O[C@@]3(C[C@@H](C)[C@H]4O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:14|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@@H](C)[C@@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](O)[C@H](OC(=O)C(C)CC)[C@]1([H])C2(C)C |r,c:24|
[H][C@]12[C@@H](OC)[C@H](OC(=O)C(\C)=C/C)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4OC(C)=O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:14|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](OC(=O)C(\C)=C\C)[C@H](OC(C)=O)[C@]1([H])C2(C)C |r,c:24|
[H][C@]12[C@@H](OC)[C@H](OC(=O)C(\C)=C/C)\C(C)=C\[C@@]34O[C@@]3(C[C@H](C)[C@@H]4O)C(=O)[C@H](C)[C@H](OC(C)=O)[C@@]1([H])C2(C)C |r,t:14|
[H][C@@]12[C@@H](OC(C)=O)[C@@H](C)C(=O)[C@@]34C[C@H](C)[C@H](OC(C)=O)[C@@]3(O4)\C=C(C)\[C@@H](OC(=O)c3ccccc3)[C@H](OC(=O)c3cccnc3)[C@]1([H])C2(C)C |r,c:24|
COc1ccc(Sc2cccc(CN(C)c3cc(nc4cc(Cl)cc(Cl)c34)C(O)=O)c2)cc1
CCOC(=O)C1=C(C)N=c2s\c(=C\c3ccc(OCc4ccc(cc4)C(O)=O)cc3)c(=O)n2C1c1ccc(cc1)N(C)C |c:5,t:8|
Cc1cccc(CSc2nnc(NC(=O)CSc3nc4ccc(cc4s3)N3C(=O)c4ccccc4C3=O)s2)c1
CCN1C(=O)N\C(=C\c2ccc(OCc3ccc(cc3)C(O)=O)c(I)c2)C1=O
[H][C@]12C[C@@H](C)C[C@@H](C)[C@]1([H])[C@@H](\C=C\C=C\C(O)=O)[C@@H](C)C=C2 |r,c:21|
C[C@H]1C[C@@H](C)c2c(C1)ccc(C)c2\C=C\C=C\C(O)=O |r|
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC\C(C)=C\CO |r|
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC\C(C)=C\COC(=O)CCC1=C(C)C(=O)NC1=O |r,c:25|
[H][C@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@@H](O)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)\C=C\C(=O)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC[C@@](O)(C=C)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CC[C@](O)(C=C)C(C)C |r,t:9|
[H][C@@]1(CC[C@@]2([H])[C@]3([H])CC=C4C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)C\C=C(/C(C)C)C(C)=O |r,t:9|
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@]1(C)CC[C@]2(O1)C(=O)C(C)=C(C)C(=O)[C@]2(C)O |r,t:26|
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@](C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O |r,c:21,t:27|
CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC\C(C)=C\COC(C)=O |r|
O\C(=C\C(=O)c1cccc(c1)N(Cc1ccccc1)Cc1ccccc1)C(=O)N1CCN(CC1)C(=O)C(\O)=C\C(=O)c1cccc(c1)N(Cc1ccccc1)Cc1ccccc1
OC(=O)C(\O)=C\C(=O)c1cccc(CN(Cc2ccccc2)Cc2ccccc2)c1
OC(=O)c1cn(C2CC2)c2ccc(Cc3ccccc3)cc2c1=O
OC(=O)c1cn(C2CC2)c2ccc(Cc3ccc(F)cc3)cc2c1=O
OC(=O)c1cn(C2CC2)c2ccc(cc2c1=O)N1CCN(Cc2ccccc2)CC1
Ic1ccc2n(cc(C(=O)OCc3ccccc3)c(=O)c2c1)C1CC1
Fc1ccc(COC(=O)c2cn(C3CC3)c3ccc(Cc4ccc(F)cc4)cc3c2=O)cc1
Ic1ccc2n(Cc3ccccc3)cc(C(=O)NCc3ccccc3)c(=O)c2c1
COC(=O)c1cc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)ccc1OC
COC(=O)c1cc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)ccc1O
COC(=O)c1cc(Cn2cc(C(=O)NCc3ccccc3)c(=O)c3cc(I)ccc23)ccc1OC
CCOC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1
OC(=O)C(\O)=C\C(=O)c1cccc(Cn2cc(C(O)=O)c(=O)c3cc(I)ccc23)c1
COC(=O)c1c(O)cccc1OCCCNC(=O)c1cn(Cc2ccccc2)c2cc(F)ccc2c1=O
COC(=O)c1c(O)cccc1OCCCNC(=O)c1cn(Cc2ccc(F)cc2)c2ccc(cc2c1=O)[N+]([O-])=O
COC(=O)c1c(OCCCN2CCN(CC2)c2ccc3n(cc(C(O)=O)c(=O)c3c2)C2CC2)cccc1OCc1ccccc1
COc1cc(O)ccc1\C=C1/SC(=O)NC1=O
COc1cc(O)c(Br)cc1\C=C1/SC(=O)NC1=O
COc1cc(OC)c(\C=C2/SC(=O)NC2=O)cc1Br
COc1cc(OCC=C)c(Br)cc1\C=C1/SC(=O)NC1=O
[#6]-[#8]-c1cc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(Br)cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7]-[#6]-1=O
CCCCOc1cc(OC)c(\C=C2/SC(=O)NC2=O)cc1Br
COc1cc(OCc2ccccc2)c(Br)cc1\C=C1/SC(=O)NC1=O
COc1cc(OC)c(\C=C2/SC(=O)N(C)C2=O)cc1Br
COc1cc(OCc2ccccc2)c(Br)cc1\C=C1/SC(=O)N(C)C1=O
[#6]-[#8]-c1cc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(Br)cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6])-[#6]-1=O
[#6]-[#8]-c1cc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(Br)cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6]-[#6]=[#6])-[#6]-1=O
[#6]-[#8]-c1cc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(Br)cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6](-[#6])-[#6])-[#6]-1=O
[#6]-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#16]\[#6](=[#6]/c2cc(Br)c(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])cc2-[#8]-[#6])-[#6]-1=O
[#6]-[#8]-c1cc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(Br)cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-1=O
[#6]-[#8]-c1cc(-[#8]-[#6]\[#6]=[#6](\[#6])-[#6])c(Br)cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6]-c2ccccc2)-[#6]-1=O
CCCCOc1cc(OC)c(\C=C2/SC(=O)N(C)C2=O)cc1Br
CCCCOc1cc(OC)c(\C=C2/SC(=O)N(CC=C)C2=O)cc1Br
CCCCOc1cc(OC)c(\C=C2/SC(=O)N(C(C)C)C2=O)cc1Br
CCCCOc1cc(OC)c(\C=C2/SC(=O)N(CCCC)C2=O)cc1Br
CCCCOc1cc(OC)c(\C=C2/SC(=O)N(Cc3ccccc3)C2=O)cc1Br
COc1cc(OC2CCCCO2)c(CC=C)cc1\C=C1/SC(=O)NC1=O
COc1cc(OC2CCCCO2)c(CC=C)cc1\C=C1/SC(=O)N(C)C1=O
COc1cc(OC2CCCCO2)c(CC=C)cc1\C=C1/SC(=O)N(C(C)C)C1=O
COc1cc(OC2CCCCO2)c(CC=C)cc1\C=C1/SC(=O)N(CC=C)C1=O
[#6]-[#8]-c1cc(-[#8]-[#6]-2-[#6]-[#6]-[#6]-[#6]-[#8]-2)c(-[#6]-[#6]=[#6])cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-1=O
CCCCN1C(=O)S\C(=C/c2cc(CC=C)c(OC3CCCCO3)cc2OC)C1=O
COc1cc(OC2CCCCO2)c(CC=C)cc1\C=C1/SC(=O)N(Cc2ccccc2)C1=O
COc1cc(O)c(CC=C)cc1\C=C1/SC(=O)N(C)C1=O
COc1cc(O)c(CC=C)cc1\C=C1/SC(=O)N(C(C)C)C1=O
COc1cc(O)c(CC=C)cc1\C=C1/SC(=O)N(CC=C)C1=O
[#6]-[#8]-c1cc(-[#8])c(-[#6]-[#6]=[#6])cc1\[#6]=[#6]-1/[#16]-[#6](=O)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-[#6]-1=O
CCCCN1C(=O)S\C(=C/c2cc(CC=C)c(O)cc2OC)C1=O
COc1cc(O)c(CC=C)cc1\C=C1/SC(=O)N(Cc2ccccc2)C1=O
COc1cc(O)c(CC=C)cc1\C=C1/SC(=O)NC1=O
CCOC(=O)c1c(N)sc(\N=C\c2ccc(cc2)[N+]([O-])=O)c1C(=O)OCC
CCOC(=O)c1c(N)sc(\N=C\c2ccc(Br)cc2)c1C(=O)OCC
CCOC(=O)c1c(N)sc(\N=C\c2ccc(cc2)N(C)C)c1C(=O)OCC
CCOC(=O)c1c(N)sc(\N=C\c2ccc(o2)[N+]([O-])=O)c1C(=O)OCC
CCOC(=O)c1c(N)sc(\N=C\c2cccs2)c1C(=O)OCC
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3)s2)cc1
Cc1ccccc1C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2)[N+]([O-])=O)cc1
Cc1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2)[N+]([O-])=O)cc1
COc1ccccc1C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2)[N+]([O-])=O)cc1
COc1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2)[N+]([O-])=O)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3Cl)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3F)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccc(F)cc3)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3[N+]([O-])=O)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3cccc(c3)[N+]([O-])=O)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccc(cc3)[N+]([O-])=O)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccco3)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3cccnc3)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)Cc3ccccc3)s2)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)Cc3cccc4ccccc34)s2)cc1
Cc1ccccc1C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
Cc1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
COc1ccccc1C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
COc1cccc(c1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
COc1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
COc1cc(cc(OC)c1OC)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3cccc(Cl)c3)s2)c(c1)[N+]([O-])=O
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3F)s2)c(c1)[N+]([O-])=O
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3[N+]([O-])=O)s2)c(c1)[N+]([O-])=O
[O-][N+](=O)c1cccc(c1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
[O-][N+](=O)c1ccc(cc1)C(=O)Nc1nnc(s1)-c1ccc(Oc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)cc1
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)Cc3ccccc3)s2)c(c1)[N+]([O-])=O
[O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)Cc3cccc4ccccc34)s2)c(c1)[N+]([O-])=O
[#8]-c1ccc(cc1)C#Cc1cccc(-c2ccc(-[#8])cc2)c1\[#6](=[#6]-1/[#6]=[#6]-[#6](=O)-[#6]=[#6]-1)-c1ccccc1 |c:27,31|
COCc1ccc(-c2ccc(O)cc2O)c(c1C#Cc1ccc(O)cc1)C(O)(c1ccc(O)cc1)c1ccc(O)cc1
OCc1ccc(-c2ccc(O)cc2O)c(c1C#Cc1ccc(O)cc1)C(O)(c1ccc(O)cc1)c1ccc(O)cc1
[#6]-[#8]-c1ccc(cc1)-[#6](=[#6]-1\[#6]=[#6]-[#6](=O)-[#6]=[#6]-1)\c1c(ccc(-[#6]-[#8])c1C#Cc1ccc(-[#8])cc1)-c1ccc(-[#8])cc1 |c:11,15|
[#8]-[#6]-c1ccc(-c2ccc(-[#8])cc2)c(\[#6](=[#6]-2/[#6]=[#6]-[#6](=O)-[#6]=[#6]-2)-c2ccc(-[#8])cc2)c1C#Cc1ccc(-[#8])cc1 |c:17,21|
OC(=O)c1nnc(o1)-c1ccc(cc1)-c1ccccc1
[H][C@@]12CC[C@@]3(C)[C@]4([H])CCC5=C(C(=O)O[C@@H]5C)[C@@]4(C)[C@H](O)C[C@]3([H])[C@@]1(C)CCC[C@]2(C)CC |r,t:10|
[H][C@@]12CCC3=C(C(=O)O[C@@H]3C)[C@@]1(C)[C@H](O)C[C@@]1([H])[C@@]2(C)CC[C@@]2([H])C(C)(C)CCC[C@]12CC |r,t:4|
[H][C@@]12OC(=O)C=C1[C@H](O)C[C@@]1([H])C(C)=C[C@]2([H])CC1(C)C |r,c:5,14,TLB:13:12:7.9.6.1:17.18|
[H][C@@]12CC(C)(C)[C@@]([H])(C[C@@H](O)c3ccoc13)C(C)=C2 |r,c:19,THB:17:16:9.8.11.15:2.3|
[H][C@@]12CC(C)(C)[C@@]([H])(C[C@@H](O)C3=CC(=O)O[C@@]13OC)C(C)=C2 |r,c:22,t:11,THB:20:19:9.8.11.16:2.3|
[H][C@@]12[C@H](O)[C@H](O)CC[C@@]1(OC)OC\C2=C\C=C |r|
OC\C(=C\C=C)c1cc(O)ccc1O
Cn1ccc2c3ccccc3n3c2c1cc(=O)c3=O
Cc1c2n(C)ccc3c4ccccc4n(c23)c(=O)c1=O
CCc1c2n(C)ccc3c4ccccc4n(c23)c(=O)c1=O
COc1ccc2c3ccn(C)c4cc(=O)c(=O)n(c2c1)c34
COc1cc2nccc3c4ccccc4n(c23)c1=O
CC(=O)Oc1cc2nccc3c4ccccc4n(c23)c1=O
Fc1cccc(c1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
Fc1ccccc1C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
COc1ccccc1C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
COc1cccc(c1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
COc1ccc(cc1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
Brc1ccc(Br)c(c1)C(=O)OCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
Brc1ccc(Br)c(c1)C(=O)OCCCCCCc1ccc(cc1)C(=O)OC1CSSC1
Brc1ccc(Br)c(c1)C(=O)OCCCCCCOc1ccc(cc1)C(=O)OC1CSSC1
Brc1ccc(Br)c(c1)C(=O)OCCOc1ccc(cc1)C(=O)OC1CSSC1
COc1ccc(C(=O)OCCCCC#Cc2ccc(cc2)C(=O)OC2CSSC2)c(OC)c1
Brc1ccc(Br)c(c1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
[O-][N+](=O)c1ccc(cc1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
[O-][N+](=O)c1cccc(c1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
[O-][N+](=O)c1ccccc1C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
Fc1ccc(cc1)C(=O)OCCCCC#Cc1ccc(cc1)C(=O)OC1CSSC1
COc1ccc(C(=O)\C=C\c2ccc(O)cc2)c(O)c1CC(O)C(C)=C
COc1ccc(C(=O)\C=C\c2ccc(O)cc2)c(O)c1CC(OO)C(C)=C
C\C=C(\C)C(=O)O[C@@H]1Cc2c(OC1(C)C)ccc1ccc(=O)oc21 |r|
CC(C)C(=O)O[C@H]1Cc2c(OC1(C)C)ccc1ccc(=O)oc21 |r|
CC1(C)Oc2ccc3ccc(=O)oc3c2[C@@H](O)[C@H]1O |r|
COc1c2ccoc2cc2oc(=O)ccc12
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC2=C(Oc3cc(cc(c3C2=O)O)O)c4ccc(c(c4)O)O)O)O)O
CCCCCCC\C=C/[C@H](O)C#CC#C[C@H](O)C=C |r|
[#6]-[#8]-c1ccc(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c(-[#8])c1-[#6]\[#6]=[#6](\[#6])-[#6]
COc1ccc(C(=O)\C=C\c2ccc(O)cc2)c(O)c1CC(=O)C(C)=C
CCOC1C(Oc2c1c(OC)ccc2C(=O)\C=C\c1ccc(O)cc1)C(C)(C)O
[#6]\[#6](-[#6])=[#6]\[#6]-[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])ccc(-[#6](=O)\[#6]=[#6]\c2ccccc2)c1-[#8]
[#6]-[#8]-c1ccc(-[#6](=O)\[#6]=[#6]\c2ccc(-[#8])cc2)c(-[#8])c1-[#6]\[#6]=[#6](/[#6])-[#6]-[#6]\[#6]=[#6](\[#6])-[#6]
Clc1cccc(c1)C(=O)\C=C\c1ccco1
Oc1ccc(C(=O)\C=C\c2ccco2)c(O)c1
Nc1cccc(c1)-c1ccc2c(cc(Nc3ccccc3)[nH]c2=O)c1
CCCCC(Oc1cc(O)c(cc1C#Cc1ccccc1OC(F)(F)F)C(O)=O)C(=O)NC1CCCCC1
CC(C)C[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(=O)P(O)([O-])=O)NC(=O)[C@H](CCC([O-])=O)NC(=O)[C@H](CC([O-])=O)NC(=O)[C@H](C)NC(=O)[C@H](CC([O-])=O)NC(C)=O)C(N)=O
CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(cc1)C(=O)P(O)([O-])=O)NC(=O)[C@H](CC(N)=O)NC(C)=O)C(=O)N[C@@H](CC([O-])=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC([O-])=O)C(N)=O
COc1ccc(cc1)-c1nnc(Nc2nc3c(F)cccc3s2)o1
CN1C(=O)\C(S\C1=N\c1ccc(CC(O)=O)cc1)=C/c1ccc(OCc2ccc(cc2)C2CCCCC2)cc1
CCCC(=O)C1=C(O)OC(C)(C)OC1=O |c:5|
CC(=O)C1=C(O)OC(C)(C)OC1=O |c:3|
CCCCCCCCCCCCCCCC(=O)C1=C(O)OC(C)(CC)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)OC1=CC(=O)OC(COCc2ccccc2)C1 |t:18|
CCCCCCCCCCCCCCCC(=O)C1C(=O)OC(=C)C1=O
CCCCCCCCCCCCCCCC(=O)C1=C(O)C(COC(=O)c2ccccc2C(=O)c2ccccc2)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)C(COC(=O)c2ccc(cc2)C(=O)c2ccccc2)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)C(COC(C)=O)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)C(COS(C)(=O)=O)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)CC(COCc2ccccc2)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)CC(CO)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)OC(C)(C)OC1=O |c:17|
CCCCCCCCCCCCCCCCCC(=O)C1=C(O)OC(C)(C)OC1=O |c:19|
CCCCCCCCCC(=O)C1=C(O)OC(C)(C)OC1=O |c:11|
CC(C)C(=O)C1=C(O)OC(C)(C)OC1=O |c:5|
CCCCCCCCCCCCCCCC(=O)C1=C(O)OC(CC)(CC)OC1=O |c:17|
CCCCCCCCCCCCCCCC(=O)C1=C(O)OC2(CCCC2)OC1=O |c:17|
[H][C@@]12CC=C3C[C@H](CC[C@]3(C)[C@@]1([H])Cc1c2ccc([C@H](C)[C@]2([H])NC[C@@H](C)C[C@H]2O)c1C)OC(C)=O |r,t:3|
[H][C@@]12C[C@H](C)CN[C@@]1([H])[C@@H](C)[C@@]1(CC[C@]3([H])C(C(=O)[C@@]4([H])[C@@]3([H])CC[C@]3([H])C[C@@H](O)C[C@@H](O)[C@]43C)=C1C)O2 |r,c:38|
[H][C@@]12C[C@H](C)CN[C@@]1([H])[C@@H](C)[C@@]1(CC[C@]3([H])C(=C[C@@]4([H])[C@@]3([H])CC=C3C[C@@H](O)CC[C@]43C)[C@@]1(C)O)O2 |r,c:17,t:25|
[H][C@@]12C[C@@]3([H])[C@@]([H])(CC=C4C[C@H](CC[C@]34C)OC=O)[C@]1([H])C[C@H](O)[C@@]1([H])[C@@]2([H])CN2C[C@@H](C)CC[C@@]2([H])[C@@]1(C)O |r,t:8|
[H][C@@]12C[C@H](C)CN[C@@]1([H])[C@@H](C)[C@@]1(CC[C@]3([H])C(C(=O)[C@@]4([H])[C@@]3([H])CC=C3C[C@H](CC[C@]43C)OC=O)=C1C)O2 |r,c:38,t:26|
[H][C@@]12CC(=O)C=C(C)[C@]1(C)CC[C@H](C)[C@@]2(C)CC\C(C)=C\C[n+]1cn(C)c2ncnc(N)c12 |r,t:5|
C[C@H]1CC(=O)C=C(C)[C@]1(C)CC\C(C)=C\CC\C(C)=C\C[n+]1cn(C)c2ncnc(N)c12 |r,t:5|
C[C@H]1CCC=C(C)[C@]1(C)CCC(C)(O)CCC\C(C)=C\C[n+]1cn(C)c2ncnc(N)c12 |r,t:4|
[H][C@]12CC(=O)C=C(C)[C@]1(C)CC[C@@H](C)[C@]2(C)CC\C(C)=C\C[n+]1cn(C)c2ncnc(N)c12 |r,t:5|
[H][C@@]12CCC=C(C)[C@]1(C)CC[C@H](C)[C@@]2(C)CCC(C)=CCn1c[n+](C)c2ncnc(N)c12
[H][C@]12CCC=C(C)[C@]1(C)CC[C@@H](C)[C@]2(C)CCC(C)=CCn1c[n+](C)c2ncnc(N)c12
[H][C@]12CCC(=C)[C@@H](CCC(C)=CCn3c[n+](C)c4ncnc(N)c34)[C@]1(C)CCCC2(C)C
C\C(CC\C=C(/C)CC[C@H]1C(=C)CCCC1(C)C)=C/C[n+]1cn(C)c2ncnc(N)c12 |r|
C[C@H]1CCC=C(C)[C@]1(C)CCC(C)=CCCC(C)=CCn1c[n+](C)c2ncnc(N)c12
[H][C@@]12CCC=C(COC(=O)c3ccc[nH]3)[C@]1(C)CC[C@H](C)[C@@]2(C)CCC(C)=CCn1c[n+](C)c2ncnc(N)c12
O=C1NC(=O)\C(S1)=C\c1ccc(cc1)-c1ccc(OCc2ccccc2)cc1
Oc1ccc(cc1)-c1cc(=O)c2c(O)c(c(O)cc2o1)-c1cc(ccc1O)-c1cc(O)c2c(cc(O)cc2=O)o1 |(14.56,-27.41,;13.23,-26.63,;11.89,-27.39,;10.56,-26.61,;10.57,-25.07,;11.9,-24.31,;13.23,-25.08,;9.25,-24.3,;7.91,-25.06,;6.59,-24.28,;5.25,-25.04,;6.6,-22.75,;5.27,-21.99,;3.93,-22.76,;5.28,-20.46,;6.6,-19.69,;6.6,-18.15,;7.93,-20.45,;7.93,-21.99,;9.26,-22.76,;3.95,-19.69,;2.61,-20.46,;1.28,-19.68,;1.28,-18.14,;2.61,-17.37,;3.95,-18.15,;5.29,-17.38,;-.06,-20.44,;-.06,-22,;-1.41,-22.77,;-1.41,-24.31,;-2.75,-21.99,;-2.75,-20.44,;-4.08,-19.67,;-5.41,-20.45,;-6.75,-19.67,;-5.42,-21.99,;-4.08,-22.76,;-4.08,-24.3,;-1.41,-19.66,)|
Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)c(-c3cc(ccc3O)-c3cc(O)c4c(cc(O)cc4=O)o3)c2o1 |(13.25,-26.01,;14.59,-25.24,;14.59,-23.7,;15.92,-22.93,;17.26,-23.7,;17.26,-25.24,;15.93,-26.01,;18.58,-22.93,;19.91,-23.69,;21.23,-22.92,;22.57,-23.69,;21.22,-21.4,;22.56,-20.64,;23.88,-21.41,;22.55,-19.1,;21.22,-18.33,;21.22,-16.79,;19.9,-19.11,;18.57,-18.34,;17.23,-19.1,;15.9,-18.33,;15.9,-16.79,;17.23,-16.02,;18.57,-16.79,;19.91,-16.02,;14.57,-19.09,;14.56,-20.65,;13.21,-21.42,;13.21,-22.96,;11.87,-20.64,;11.88,-19.08,;10.54,-18.32,;9.21,-19.09,;7.87,-18.32,;9.21,-20.64,;10.54,-21.41,;10.54,-22.95,;13.22,-18.3,;19.9,-20.64,;18.58,-21.4,)|
Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)c(-c3c(O)cc(O)c4c3oc(cc4=O)-c3ccc(O)cc3)c2o1 |(5.18,-39.53,;3.84,-40.3,;3.85,-41.86,;2.51,-42.63,;1.18,-41.86,;1.18,-40.31,;2.51,-39.54,;-.15,-42.62,;-.15,-44.15,;-1.48,-44.92,;-1.48,-46.46,;-2.8,-44.15,;-4.14,-44.93,;-4.14,-46.48,;-5.47,-44.16,;-5.47,-42.62,;-6.8,-41.84,;-4.13,-41.86,;-4.13,-35.97,;-5.46,-35.2,;-6.8,-35.97,;-5.46,-33.67,;-4.13,-32.9,;-4.13,-31.36,;-2.8,-33.65,;-2.79,-35.2,;-1.45,-35.97,;-.11,-35.19,;-.12,-33.64,;-1.46,-32.87,;-1.46,-31.33,;1.21,-35.96,;1.22,-37.5,;2.55,-38.27,;3.88,-37.5,;5.22,-38.27,;3.88,-35.96,;2.55,-35.19,;-2.8,-42.62,;-1.48,-41.85,)|
Oc1ccc(cc1)-c1cc(=O)c2ccc(O)c(-c3cc([C@@H]4CC(=O)c5c(O)cc(O)cc5O4)c(O)cc3O)c2o1 |r,wD:20.20,(1.56,-5.97,;2.63,-5.36,;3.96,-6.14,;5.3,-5.38,;5.31,-3.84,;3.98,-3.06,;2.64,-3.82,;6.65,-3.07,;7.97,-3.85,;9.31,-3.09,;10.37,-3.71,;9.32,-1.55,;10.65,-.79,;10.67,.76,;9.34,1.54,;9.34,2.77,;8,.76,;6.66,1.53,;5.33,.77,;4,1.54,;2.66,.77,;2.66,-.77,;1.33,-1.54,;1.33,-2.77,;,-.77,;-1.33,-1.54,;-1.33,-2.77,;-2.68,-.77,;-2.68,.77,;-3.75,1.39,;-1.33,1.54,;,.77,;1.33,1.54,;4,3.08,;2.93,3.7,;5.33,3.85,;6.67,3.07,;7.73,3.69,;7.99,-.78,;6.65,-1.54,)|
Oc1ccc(cc1)-c1oc2cc(O)cc(O)c2c(=O)c1-c1cc(ccc1O)-c1cc(=O)c2c(O)cc(O)cc2o1 |(2.2,-12.35,;.87,-13.13,;.88,-14.67,;-.45,-15.44,;-1.79,-14.67,;-1.8,-13.14,;-.47,-12.36,;-3.12,-15.45,;-4.47,-14.67,;-5.81,-15.46,;-7.15,-14.7,;-8.47,-15.47,;-9.81,-14.7,;-8.48,-17.01,;-7.14,-17.78,;-7.15,-19.32,;-5.8,-17.02,;-4.46,-17.78,;-4.45,-19.32,;-3.11,-17,;-1.78,-17.77,;-.46,-17,;.88,-17.76,;.89,-19.3,;-.45,-20.08,;-1.78,-19.31,;-3.11,-20.08,;2.21,-16.98,;2.19,-15.44,;3.52,-14.67,;3.52,-13.13,;4.86,-15.43,;6.18,-14.67,;6.17,-13.13,;7.51,-15.42,;7.52,-16.96,;8.86,-17.73,;6.19,-17.73,;4.86,-16.97,;3.54,-17.75,)|
Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)c(-c3c(oc4cc(O)cc(O)c4c3=O)-c3ccc(O)cc3)c2o1 |(4.11,-9.88,;3.39,-11.25,;4.21,-12.55,;3.49,-13.91,;1.94,-13.97,;1.13,-12.67,;1.84,-11.31,;1.22,-15.32,;2.03,-16.61,;1.32,-17.95,;2.13,-19.25,;-.19,-18,;-.92,-19.36,;-.11,-20.67,;-2.45,-19.41,;-3.25,-18.11,;-4.31,-19.19,;-2.52,-16.76,;-3.32,-15.46,;-3.32,-13.91,;-4.67,-13.14,;-6,-13.93,;-7.34,-13.16,;-8.67,-13.94,;-10.01,-13.17,;-8.67,-15.48,;-7.34,-16.25,;-7.34,-17.8,;-6,-15.48,;-4.66,-16.24,;-4.56,-17.65,;-2.16,-12.91,;-.7,-13.43,;.47,-12.42,;.18,-10.91,;1.35,-9.9,;-1.28,-10.4,;-2.45,-11.41,;-1,-16.72,;-.3,-15.38,)|
NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(cc1)C(F)(F)P(O)(O)=O |r|
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)NCc1ccccc1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(OC)c(OC)c1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1cccc(OC)c1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(Br)cc1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccc(C)cc1
CCOc1cc(NS(C)(=O)=O)c(OCC)cc1CNC(=O)Nc1ccccc1
c1ccc(cc1)CP(=O)(O)O
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCCN1C(=O)CN)C(C)(C)C)[C@@H](C)CC)C(C)(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N1[C@@H](CSC1(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OC(C)=O)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OC(=O)c4ccccc4)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OC(=O)\C=C\C)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OC(=O)\C=C\c4ccccc4)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OC)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OCC)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12CC(C)(C)CC[C@@]1(CC[C@]1(C)C2=CC[C@]2([H])[C@@]3(C)CC[C@H](OCCC)C(C)(C)[C@]3([H])CC[C@@]12C)C(O)=O |r,t:15|
[H][C@@]12C[C@H](O)[C@]3(C)Oc4cc(O)c5C(=O)O[C@H](C)Cc5c4C[C@@]3([H])[C@@]1(C)CCC(=O)C2(C)C |r|
[H][C@@]12C[C@H](O)[C@]3(C)Oc4cc(O)c5C(=O)O[C@H](C)[C@H](O)c5c4C[C@@]3([H])[C@@]1(C)C=CC(=O)C2(C)C |r,c:31|
[H][C@@]12CC[C@]3(C)Oc4cc(O)c5C(=O)O[C@H](C)Cc5c4C[C@@]3([H])[C@@]1(C)C=CC(=O)C2(C)C |r,c:29|
CC(C)c1ccc(NC(=O)C(=O)Nc2ccc(NC(=O)C(c3ccccc3)S(O)(=O)=O)cc2)cc1
OS(=O)(=O)C(C(=O)Nc1ccc(NC(=O)C(=O)Nc2ccc(cc2)-c2ccccc2)cc1)c1ccccc1
OS(=O)(=O)C(C(=O)Nc1ccc(NC(=O)C(=O)Nc2ccc(I)cc2)cc1)c1ccccc1
NC(=O)c1cc[n+](CC2=C(N3[C@H](SC2)[C@H](NC(=O)C(c2ccccc2)S(O)(=O)=O)C3=O)C(O)=O)cc1 |t:8|
[H][C@@]12CC[C@]3(C)[C@]([H])(CC[C@]4(C)Oc5ccccc5C[C@@]34[H])[C@@]11CCC[C@@]2(C)[C@@H](OC)OC1 |r,THB:29:28:24.25.23:1|
[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 |r,THB:30:29:1:24.25.26|
[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 |r|
[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 |r,THB:32:31:21:25.27.26|
[H][C@@]12CC[C@]3(C)[C@]([H])(CC[C@]4(C)Oc5ccc(O)cc5C[C@@]34[H])[C@@]11CCC[C@@]2(C)[C@@H](O)OC1 |r,THB:30:29:25.26.24:1|
[H][C@@]12CC[C@]3(C)[C@]([H])(CC[C@]4(C)Oc5ccc(O)cc5C[C@@]34[H])[C@@]1(CO)CCC[C@]2(C)CO |r|
[H][C@@]12CC[C@@]3(C)[C@H](Cc4cc(O)ccc4O)[C@@](C)(O)CC[C@]3([H])[C@@]11CCC[C@@]2(C)[C@@H](OCC)OC1 |r,THB:30:29:25.26.24:1|
Clc1ccccc1COc1ccc(\C=C2\N(Cc3ccccc3Cl)C(=O)N(Cc3ccccc3Cl)C2=O)cc1
COc1ccc(COc2ccc(\C=C3\N(Cc4ccc(OC)cc4)C(=O)N(Cc4ccc(OC)cc4)C3=O)cc2)cc1
Clc1ccc(COc2ccc(\C=C3\N(Cc4ccc(Cl)c(Cl)c4)C(=O)N(Cc4ccc(Cl)c(Cl)c4)C3=O)cc2)cc1Cl
CCOC(=O)COc1ccc(\C=C2\N(CC(=O)OCC)C(=O)NC2=O)cc1
Clc1ccc(COc2ccc(\C=C3\N(Cc4ccc(Cl)c(Cl)c4)C(=O)NC3=O)cc2)cc1Cl
COc1ccc(COc2ccc(\C=C3\N(Cc4ccc(OC)cc4)C(=O)NC3=O)cc2)cc1
CCOC(=O)COc1ccc(\C=C2\NC(=O)NC2=O)cc1
Clc1ccccc1COc1ccc(\C=C2\NC(=O)NC2=O)cc1
COC(=O)COC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(OCC(=O)OC)cc2)C1=O
OC(=O)c1ccc(CN2C(=O)N(Cc3ccccc3)\C(=C\c3ccc(O)cc3)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)N(Cc3ccccc3)\C(=C\c3ccc(OCc4ccccc4)cc3)C2=O)cc1
OC(=O)c1ccc(COc2ccc(\C=C3\N(Cc4ccccc4)C(=O)N(Cc4ccc(cc4)C(O)=O)C3=O)cc2)cc1
OC(=O)COc1ccc(\C=C2\N(Cc3ccccc3)C(=O)N(CC(O)=O)C2=O)cc1
CCOC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(OCc3ccccc3)cc2)C1=O
COC(=O)COc1ccc(\C=C2\N(Cc3ccccc3)C(=O)N(Cc3ccc(cc3)C(=O)OC)C2=O)cc1
COC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(OCc3ccccc3)cc2)C1=O
O=C1NC(=O)\C(N1)=C/c1ccc(OCCCc2ccccc2)cc1
Clc1ccc(COc2ccc(\C=C3\NC(=O)NC3=O)cc2)cc1Cl
COC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(O)cc2)C1=O
COC(=O)c1ccc(CN2C(=O)N(Cc3ccccc3)\C(=C\c3ccc(O)cc3)C2=O)cc1
COC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(OCc3ccc(cc3)C(=O)OC)cc2)C1=O
COC(=O)COC(=O)c1ccc(CN2C(=O)N(Cc3ccccc3)\C(=C\c3ccc(OCC(=O)OC)cc3)C2=O)cc1
O=C(COc1ccc(\C=C2\N(CC(=O)c3ccccc3)C(=O)N(CC(=O)c3ccccc3)C2=O)cc1)c1ccccc1
Clc1ccc(COc2ccc(\C=C3\N(Cc4ccc(Cl)cc4Cl)C(=O)N(Cc4ccc(Cl)cc4Cl)C3=O)cc2)c(Cl)c1
O=C1NC(=O)\C(=C/c2ccc(OCc3ccccc3)cc2)N1Cc1ccccc1
Clc1ccc(COc2ccc(\C=C3\N(Cc4ccc(Cl)cc4)C(=O)NC3=O)cc2)cc1
Clc1ccc(COc2ccc(\C=C3\N(Cc4ccc(Cl)cc4Cl)C(=O)NC3=O)cc2)c(Cl)c1
O=C1NC(=O)\C(N1)=C/c1ccc(OCc2ccccc2)cc1
O=C(COc1ccc(\C=C2\NC(=O)NC2=O)cc1)c1ccccc1
Clc1ccc(COc2ccc(\C=C3\NC(=O)NC3=O)cc2)c(Cl)c1
COC(=O)c1ccc(COC(=O)CN2C(=O)N(Cc3ccccc3)\C(=C\c3ccc(OCc4ccc(cc4)C(=O)OC)cc3)C2=O)cc1
OC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(O)cc2)C1=O
OC(=O)COc1ccc(\C=C2\N(Cc3ccccc3)C(=O)N(Cc3ccc(cc3)C(O)=O)C2=O)cc1
OC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(OCc3ccccc3)cc2)C1=O
OC(=O)CN1C(=O)N(Cc2ccccc2)\C(=C\c2ccc(OCc3ccc(cc3)C(O)=O)cc2)C1=O
COC(=O)c1ccc(CN2C(=O)N(Cc3ccccc3)\C(=C\c3ccc(OCc4ccccc4)cc3)C2=O)cc1
COC(=O)c1ccc(COc2ccc(\C=C3\N(Cc4ccccc4)C(=O)N(Cc4ccc(cc4)C(=O)OC)C3=O)cc2)cc1
COC(=O)COc1ccc(\C=C2\N(Cc3ccccc3)C(=O)N(CC(=O)OC)C2=O)cc1
Clc1ccc(COc2ccc(\C=C3\NC(=O)NC3=O)cc2)cc1
Clc1cccc(Cn2nnc3c2C(=O)c2ccccc2C3=O)c1
CN1CCN(CC1)C(=O)c1cccc(Cn2nnc3c2C(=O)c2ccccc2C3=O)c1
CN(CC(=O)N(Cc1ccc(cc1)C1CCCCC1)c1ccc(C(O)=O)c(O)c1)S(=O)(=O)c1cccc2cccnc12
OC(=O)c1ccc(NC(=O)Cn2cc(CN(CC(=O)N(Cc3ccc(cc3)C3CCCCC3)c3ccc(C(O)=O)c(O)c3)S(=O)(=O)c3cccc4cccnc34)nn2)cc1O
OC(=O)c1ccc(NC(=O)CCn2cc(CN(CC(=O)N(Cc3ccc(cc3)C3CCCCC3)c3ccc(C(O)=O)c(O)c3)S(=O)(=O)c3cccc4cccnc34)nn2)cc1O
OC(=O)c1ccc(NC(=O)CCCn2cc(CN(CC(=O)N(Cc3ccc(cc3)C3CCCCC3)c3ccc(C(O)=O)c(O)c3)S(=O)(=O)c3cccc4cccnc34)nn2)cc1O
OC(=O)c1ccc(NC(=O)CCCCn2cc(CN(CC(=O)N(Cc3ccc(cc3)C3CCCCC3)c3ccc(C(O)=O)c(O)c3)S(=O)(=O)c3cccc4cccnc34)nn2)cc1O
OC(=O)c1ccc(NC(=O)CCCCCn2cc(CN(CC(=O)N(Cc3ccc(cc3)C3CCCCC3)c3ccc(C(O)=O)c(O)c3)S(=O)(=O)c3cccc4cccnc34)nn2)cc1O
CC(=O)NCCCSCCNC(=O)[C@@H]1CC[C@@H](CC1)NC(=O)c1nccnc1C(O)=O |r,wU:16.19,13.12,(-13.59,-15.26,;-14.66,-14.64,;-15.72,-15.26,;-14.66,-13.1,;-13.33,-12.33,;-13.33,-10.79,;-12,-10.01,;-12,-8.47,;-10.67,-7.7,;-10.67,-6.16,;-9.34,-5.39,;-9.34,-3.85,;-10.41,-3.23,;-8.01,-3.07,;-6.67,-3.84,;-5.34,-3.07,;-5.34,-1.53,;-6.67,-.76,;-8.01,-1.53,;-4,-.77,;-2.67,-1.54,;-2.67,-2.77,;-1.33,-.77,;-1.33,.77,;,1.54,;1.33,.77,;1.33,-.77,;,-1.54,;0,-3.08,;-1.06,-3.7,;1.07,-3.7,)|
COC(=O)CN(c1ccc(CN(c2ccc(CN(Cc3ccccc3)S(C)(=O)=O)cc2)S(=O)(=O)c2ccccc2)cc1)S(C)(=O)=O
COC(=O)CN(c1ccc(CN(c2ccc(CN(Cc3ccccc3)S(C)(=O)=O)cc2)S(=O)(=O)c2ccc(OC)cc2)cc1)S(C)(=O)=O
CCOc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)N(CC(=O)OC)S(C)(=O)=O)c1ccc(CN(Cc2ccccc2)S(C)(=O)=O)cc1
CCCOc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)N(CC(=O)OC)S(C)(=O)=O)c1ccc(CN(Cc2ccccc2)S(C)(=O)=O)cc1
CCCCOc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)N(CC(=O)OC)S(C)(=O)=O)c1ccc(CN(Cc2ccccc2)S(C)(=O)=O)cc1
COC(=O)CN(c1ccc(CN(c2ccc(CN(Cc3ccc(C)cc3)S(C)(=O)=O)cc2)S(=O)(=O)Cc2ccccc2)cc1)S(C)(=O)=O
COC(=O)CN(c1ccc(CN(c2ccc(cc2)N(Cc2ccccc2)S(C)(=O)=O)S(=O)(=O)Cc2ccccc2)cc1)S(C)(=O)=O
CCOc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)N(Cc1ccc(cc1)N(CC(=O)OC)S(=O)(=O)CC)S(=O)(=O)Cc1ccccc1
CCCCOc1ccc(cc1)S(=O)(=O)N(Cc1ccc(cc1)N(CC(=O)OC)S(C)(=O)=O)c1ccc(NS(=O)(=O)Cc2ccccc2)cc1
[H][C@]12C=C(C)CC[C@@]1([H])[C@](C)(CC[C@H]2C(C)C)N=C=S |r,t:2|
[H][C@]1([#6]-[#6]-[#6](-[#6])=[#6]-[#6]1)[C@@]([#6])([#7])[#6]-[#6]\[#6]=[#6](\[#6])-[#6] |r,c:5|
[H][C@]1([#6]-[#6]-[#6](-[#6])=[#6]-[#6]1)[C@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[#7]-[#6](=O)-[#7][C@@]([#6])([#6]-[#6]\[#6]=[#6](\[#6])-[#6])[C@]1([H])[#6]-[#6]-[#6](-[#6])=[#6]-[#6]1 |r,c:5,34|
[#6]-[#8]-c1ccc(-[#6]-[#6]-[#6](=O)-[#6]-2=[#6](-[#8])-[#6](-[#6]\[#6]=[#6](\[#6])-[#6])=[#6]3-[#8]C([#6])([#6])[#6]=[#6]C3([#6]\[#6]=[#6](\[#6])-[#6])[#6]-2=O)cc1-[#8] |c:10,24,t:18|
[#6]-[#8]-c1ccc(-[#6]-[#6]\[#6](-[#8])=[#6]-2/[#6](=O)-[#6](-[#6]\[#6]=[#6](\[#6])-[#6])=[#6]3-[#8]C([#6])([#6])[#6]=[#6]C3([#6]\[#6]=[#6](\[#6])-[#6])[#6]-2=O)cc1-[#8] |c:24,t:18|
[#6]-[#8]-c1ccc(-[#6]-[#6]-[#6](=O)-[#6]-2=[#6](-[#8])-[#6](-[#6]\[#6]=[#6](\[#6])-[#6])=[#6]3-[#8]C([#6])([#6])[#6]=[#6]C3([#6]\[#6]=[#6](\[#6])-[#6])[#6]-2=O)cc1 |c:10,24,t:18|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c2-[#8]C([#6])([#6])[#6]=[#6]-c2c(-[#8])c2c1occ(-c1ccc(-[#8])c(-[#8])c1)c2=O |c:11|
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c2occ(-c3ccc(-[#8])c(-[#8])c3)c(=O)c2c1-[#8]
[#6]-[#8]-c1cc(ccc1-[#8])-c1coc2c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])c2c1=O
[#6]\[#6](-[#6])=[#6]\[#6]-c1c(-[#8])c2c(occ(-c3ccc(-[#8])cc3)c2=O)c2-[#6]=[#6]C([#6])([#6])[#8]-c12 |c:25|
CCCOc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
COC(=O)CCCOc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
Oc1ccc(cc1)-c1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCOc1ccc(cc1)-c1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCOc1ccc(cc1)-c1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCCc1ccc(cc1)-c1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
Cc1cccc(c1)-c1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
Cc1ccccc1-c1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
Brc1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
Brc1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
Brc1cccc(n1)-c1noc(Cc2c[nH]c3ccccc23)n1
Nc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
Cc1ccccc1-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
Cc1cccc(c1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCCc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCOc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCOc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
COC(=O)CCCOc1ccc(cc1)-c1ccc(s1)-c1noc(Cc2c[nH]c3ccccc23)n1
Oc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
Nc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
Cc1ccccc1-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
Cc1cccc(c1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCCCc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
CCOc1ccc(cc1)-c1cccc(c1)-c1noc(Cc2c[nH]c3ccccc23)n1
[H][C@@]12CCC(=C)[C@H](CC[C@H](C)CCO)[C@@]1(C)CCC[C@]2(C)C(O)=O |r|
[H][C@@]12CCC(=C)[C@H](CC[C@H](C)CCO)[C@@]1(C)CCC[C@]2(C)NC(N)=O |r|
[H][C@@]12CCC(=C)[C@H](CC[C@H](C)CNC(N)=O)[C@@]1(C)CCC[C@]2(C)NC(N)=O |r|
[H][C@@]12CCC(=C)[C@H](CC[C@H](C)C\C=N\OC(C)=O)[C@@]1(C)CCC[C@]2(C)NC(N)=O |r|
[H][C@@]12CCC(=C)[C@H](CC[C@H](C)C\C=N\O)[C@@]1(C)CCC[C@]2(C)NC(N)=O |r|
[H][C@]12CC[C@]3([H])[C@@]4(C)CCC(=O)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@]1(CCC(C)(C)C=C21)C(=O)OC |r,t:34|
[H][C@]12CC[C@]3([H])[C@@]4(C)CCC5(OCCO5)C(C)(C)[C@]4([H])CC[C@@]3(C)[C@]1(C)CC[C@@]1(CO)CCC(C)(C)C=C21 |r,t:40|
CO[C@H]1O[C@H](Cn2cc(NC(=O)c3cccc(c3)C(=O)Nc3cn(C[C@H]4O[C@H](OC)[C@H](OCc5ccccc5)[C@H](OCc5ccccc5)[C@@H]4OCc4ccccc4)nn3)nn2)[C@@H](OCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1 |r|
CO[C@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H](OCc2cn(CCCOc3ccc(O)c(c3)C(O)=O)nn2)[C@H]1OCc1cn(CCCOc2ccc(O)c(c2)C(O)=O)nn1 |r|
OC(=O)C(=O)c1ccc(OCc2ccc(COc3ccc(cc3)C(=O)C(O)=O)c(c2)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1
CCc1cc(ccc1N(c2ccccc2C(=O)O)C(=O)C(=O)O)C[C@@H](C(=O)NCCCCC(=O)N[C@@H](CCSC)C(=O)O)NC(=O)C
CCCCCNC(=O)[C@H](Cc1ccc(C(=O)C(=O)Nc2ccccc2C(O)=O)c(\C=C\C(N)=O)c1)NS(C)(=O)=O |r|
Cc1noc(n1)-c1ccc(cc1)C(C\C=C\c1ccccc1)(Cc1ccc(cc1)C(F)(F)P(O)(O)=O)C(=O)c1ccc(F)cc1
NC(=O)[C@H](Cc1ccc(cc1)C(F)(F)P(O)(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Cc1ccc(cc1)C(F)(F)P(O)(O)=O |r|
CO[C@H]1O[C@H](COCc2ccccc2)[C@@H](OCc2cn(nn2)[C@@H](Cc2ccc(O)cc2)C(=O)OC)[C@@H](OCc2cn(nn2)[C@@H](Cc2ccc(O)cc2)C(=O)OC)[C@H]1OCc1ccccc1 |r|
CC(=O)N[C@H](Cc1ccc(N(C(=O)C(O)=O)c2ccccc2C(O)=O)c2ccccc12)C(=O)NCCCCCOc1cc2ccccc2cc1C(O)=O |r|
COC(=O)CN(c1ccc(CN(c2ccc(OCc3ccccc3)c(c2)C(=O)OC)S(=O)(=O)Cc2ccccc2)cc1)S(C)(=O)=O
COC(=O)CN(c1ccc(CN(c2ccc(OCc3ccccc3)cc2)S(=O)(=O)Cc2ccccc2)cc1)S(C)(=O)=O
CCCCOc1ccc(cc1C(=O)OC)N(Cc1ccc(cc1)N(CC(=O)OC)S(C)(=O)=O)S(=O)(=O)Cc1ccccc1
CCCOc1ccc(cc1C(=O)OC)N(Cc1ccc(cc1)N(CC(=O)OC)S(C)(=O)=O)S(=O)(=O)Cc1ccccc1
COC(=O)CN(c1ccc(CN(c2ccc(OCc3ccc(C)cc3)c(c2)C(=O)OC)S(=O)(=O)Cc2ccccc2)cc1)S(C)(=O)=O
[H][C@@]12CC[C@@H](C)C3=CC[C@](C)([C@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r,t:6|
[H][C@@]12CC=C3[C@]([H])(CC[C@@H](C)[C@]3(C)[C@]1([H])C2(C)C)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:3|
[H][C@@]12CC=C3[C@]([H])(CC[C@@H](C)[C@]3(C)[C@]1([H])C2(C)C)[C@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:3|
[H][C@]12CC[C@](C)(Cc3c(O)c(C=O)c(O)c(C(=O)CC(C)C)c3O)C1=C[C@@H](CC[C@H]2C)C(C)(C)O |r,c:26|
[H][C@@]12CC[C@@](C)(OC)[C@]3([H])CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r|
[H][C@@]12CC[C@@H](C)C3=CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r,t:6|
[H][C@@]12CCC(C)=C3CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r,t:5|
[H][C@@]12CC[C@](C)(O)[C@]3([H])CC[C@](C)([C@@H](CC(C)C)c4c(O)c(C=O)c(O)c(C=O)c4O)[C@@]3([H])[C@]1([H])C2(C)C |r|
[H][C@]1(CC[C@H](C)C2=C[C@H](CC[C@@]12C)C(C)=C)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,t:6|
[H][C@@]12CC[C@@H](C)C3=C([C@]1([H])C2(C)C)[C@](C)(CC3)[C@@H](CC(C)C)c1c(O)c(C=O)c(O)c(C=O)c1O |r,c:6|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)ccc1OC(C)=O |r,t:4|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(OC(C)=O)ccc1OC(C)=O |r|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(OC(C)=O)ccc1O |r|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(OC(C)=O)ccc1O |r,t:4|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@@]1(C)Oc3ccc(O)cc3C[C@@]21C |r,t:4|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)ccc1O |r|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(OC(=O)CC)ccc1OC(=O)CC |r|
C[C@H]1CC[C@@]2(C)[C@@H](CCC=C2C)[C@]1(C)Cc1cc(O)ccc1O |r,c:9|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(OC(=O)CC)ccc1OC(=O)CC |r,t:4|
[H][C@@]12CCC=C(C)[C@@]1(C)CC[C@H](C)[C@@]2(C)CC1=CC(=O)C=C(N)C1=O |r,t:4,18,22|
[H][C@@]12CCCC(=C)[C@@]1(C)CC[C@H](C)[C@@]2(C)Cc1cc(O)ccc1OC(C)=O |r|
O=C1CC(c2ccc(CC(Nc3nc4ccccc4s3)c3nc4ccccc4[nH]3)cc2)S(=O)(=O)N1
CCOC(=O)c1c(C)[nH]c(\C=C2/S\C(=N/c3ccc(F)cc3)N(C2=O)c2ccc(F)cc2)c1C
CCOC(=O)c1c(C)[nH]c(\C=C2/S\C(=N/c3cccc(F)c3)N(C2=O)c2cccc(F)c2)c1C
CCOC(=O)c1c(C)[nH]c(\C=C2/S\C(=N/c3ccccc3)N(C2=O)c2ccccc2)c1C
Cc1cc(I)cc2C3C=CCC3C(Nc12)c1cccc(N)c1 |c:8|
Nc1c(cnn1-c1ccc(CN(Cc2ccc(F)cc2)Cc2ccc(Cl)cc2)cc1)C(O)=O
COc1ccc(CN(Cc2ccc(F)cc2)Cc2ccc(cc2)-n2ncc(C(O)=O)c2N)cc1OC
Nc1c(cnn1-c1ccc(CN(Cc2ccc(Cl)cc2)Cc2ccc(F)c(F)c2)cc1)C(O)=O
COc1ccc(cc1)C(Cc1ccc(cc1)-n1ncc(C(O)=O)c1N)c1nc(no1)-c1ccc(Cl)cc1
Nc1c(cnn1-c1ccc(CC(c2nc(no2)-c2ccc(Cl)cc2)c2ccc(F)cc2)cc1)C(O)=O
COc1ccc(cc1)-c1noc(n1)C(Cc1ccc(cc1)-n1ncc(C(O)=O)c1N)c1ccc(F)cc1
Nc1c(cnn1-c1ccc(CN(Cc2ccc(F)cc2)Cc2ccc(F)c(F)c2)cc1)C(O)=O
COc1ccc(cc1)C(Cc1ccc(cc1)-n1ncc(C(O)=O)c1N)c1nc(no1)-c1cccc(F)c1
COc1ccc(CN(Cc2ccc(OC)cc2)Cc2ccc(cc2)-n2ncc(C(O)=O)c2N)cc1
C[C@@H]1Cc2c(C\C=C(/C)CC\C=C(/C)CC[C@H](O)C(C)(C)O)c(O)cc(O)c2C(=O)O1 |r|
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(F)cc2)=C\c2ccc(Oc3ccccc3)cc2)cc1
OC(=O)c1ccc(CN2C(=S)S\C(=C/c3ccc(OCCc4ccccc4)cc3)C2=O)cc1
OC(=O)c1ccc(CN2C(=S)S\C(=C/c3ccc(OCc4ccccc4)cc3)C2=O)cc1
OC(=O)c1ccc(CN2C(=S)S\C(=C/c3cccc(Oc4ccccc4)c3)C2=O)cc1
OC(=O)c1ccc(CN2C(=S)S\C(=C/c3ccc(Oc4ccccc4)cc3)C2=O)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(F)cc2)=C\c2ccc(OCCc3ccccc3)cc2)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(F)cc2)=C\c2cccc(OCc3ccccc3)c2)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(F)cc2)=C\c2ccc(OCc3ccccc3)cc2)cc1
OC(=O)c1ccc(CN2C(=O)\C(S\C2=N/c2ccc(F)cc2)=C\c2cccc(OCCc3ccccc3)c2)cc1
OC(=O)c1ccc(CN2C(=S)S\C(=C/c3cccc(OCc4ccccc4)c3)C2=O)cc1
C[C@@H](CCC\C(C)=C\CCC(C)(O)CCCc1ccoc1)C=C1OC(=O)C(C)C1=O |r,w:22.23|
C[C@@H](CCCc1ccoc1)C[C@@H](O)C\C(C)=C\CCc1ccoc1 |r|
C[C@@H](CCCc1ccoc1)C[C@H](C\C(C)=C\CCc1ccoc1)OC(C)=O |r|
C[C@@H](CCC\C(C)=C\CC\C(C)=C\CCc1ccoc1)\C=C1/OC(=O)C(C)=C1O |r,c:27|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(C)cc3)[C@@]3(O[C@@]1([H])c1cccc(OC)c1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(C)cc3)[C@@]3(O[C@@]1([H])c1cc(Cl)ccc1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(C)cc3)[C@@]3(O[C@@]1([H])c1cc(OC)ccc1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccccc3)[C@@]3(O[C@@]1([H])c1cc(C)ccc1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
COC(=O)\C=C\Oc1c(OC)cccc1[C@@H]1O[C@]2([C@H]([C@@H]1[N+]([O-])=O)c1ccc(Br)cc1)C(=O)N(Cc1ccccc1)c1ccccc21 |r|
COC(=O)\C=C\Oc1ccc(OC)cc1[C@@H]1O[C@]2([C@H]([C@@H]1[N+]([O-])=O)c1ccc(Br)cc1)C(=O)N(Cc1ccccc1)c1ccccc21 |r|
COC(=O)\C=C\Oc1ccc(OC)cc1[C@@H]1O[C@]2([C@H]([C@@H]1[N+]([O-])=O)c1ccc(C)cc1)C(=O)N(Cc1ccccc1)c1ccccc21 |r|
[H][C@@]12O[C@]3([C@@H](c4ccc(Br)cc4)[C@@]1([C@@H](CC(=O)OC)Oc1c(OC)cccc21)[N+]([O-])=O)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12O[C@]3([C@@H](c4ccc(Br)cc4)[C@@]1([C@@H](CC(=O)OC)Oc1ccc(OC)cc21)[N+]([O-])=O)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12O[C@]3([C@@H](c4ccc(C)cc4)[C@@]1([C@@H](CC(=O)OC)Oc1c(OC)cccc21)[N+]([O-])=O)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12O[C@]3([C@@H](c4ccc(C)cc4)[C@@]1([C@@H](CC(=O)OC)Oc1ccc(OC)cc21)[N+]([O-])=O)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12O[C@]3([C@@H](c4ccccc4OC)[C@@]1([C@@H](CC(=O)OC)Oc1c(OC)cccc21)[N+]([O-])=O)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(Br)cc3)[C@@]3(O[C@@]1([H])c1cccc(OC)c1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(Br)cc3)[C@@]3(O[C@@]1([H])c1cc(OC)ccc1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(C)cc3)[C@@]3(O[C@@]1([H])c1cc(C)ccc1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
COC(=O)\C=C\Oc1c(OC)cccc1[C@@H]1O[C@]2([C@H]([C@@H]1[N+]([O-])=O)c1ccc(C)cc1)C(=O)N(Cc1ccccc1)c1ccccc21 |r|
[H][C@@]12O[C@]3([C@@H](c4ccc(Br)cc4)[C@@]1([C@@H](CC(=O)OC)Oc1ccc(Cl)cc21)[N+]([O-])=O)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccccc3OC)[C@@]3(O[C@@]1([H])c1cccc(OC)c1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
[H][C@@]12CC(=O)N[C@@]11[C@H](c3ccc(Br)cc3)[C@@]3(O[C@@]1([H])c1cc(Cl)ccc1O2)C(=O)N(Cc1ccccc1)c1ccccc31 |r|
CCCCCCCC(C)CCC\C(O)=C1/C(=O)C(C)N(C)C1=O
CC\C=C/C\C=C/C\C=C/CCCCCCCC1(O)CC(=O)c2c(O)c(C)c(O)c(C)c2O1
CCCCC\C=C/C\C=C/CCCCCCCC1(O)CC(=O)c2c(O)c(C)c(O)c(C)c2O1
CCCCCCCCCCCCCCCC1(O)CC(=O)c2c(O)cc(O)cc2O1
CCCC\C=C/CCCCCCCCCC1(O)CC(=O)c2c(O)c(C)c(O)c(C)c2O1