Compound Name

SMILES String

C1CN(C(=N1)c1ccc(cc1)C1=NCCN1c1ccccc1)c1ccccc1 |c:3,t:13|

C1CN(C(=N1)c1ccc(cc1)C1=NCCN1c1ccccn1)c1ccccn1 |c:3,t:13|

C1CN(C(=N1)c1ccc(cc1)C1=NCCN1c1cccnc1)c1cccnc1 |c:3,t:13|

C1CN(C(=N1)c1ccc(cc1)C1=NCCN1c1cnccn1)c1cnccn1 |c:3,t:13|

C1CN=C(N1)c1ccc(cc1)C1=NCCN1c1ccccc1 |c:2,t:13|

CC(=O)CC(=O)C(O)=O

CC(=O)N1CCC(CC1)n1cc(O)c(=O)cc1C

CC(=O)NCc1cc(=O)c(O)co1

CC(=O)Nc1cccc(c1)-c1nc(C(O)=O)c(O)c(=O)[nH]1

CC(=O)c1c(O)n(O)c2cc(NC(=O)C=Cc3ccccc3Cl)ccc12 |w:15.15|

CC(=O)c1c(O)n(O)c2cc(NC(=O)Nc3cccc(c3)C(O)=O)ccc12

CC(=O)c1c(O)n(O)c2cc(NC(=O)c3ccc4ccccc4c3)ccc12

CC(=O)c1c(O)n(O)c2cc(NC(=O)c3cccs3)ccc12

CC(=O)c1c(O)n(O)c2cc(NC(=O)c3cnc4ccccc4n3)ccc12

CC(C)(C)OC(=O)C(=O)CC(=O)c1ccccc1

CC(C)C(=O)CC(=O)C(O)=O

CC(C)C=c1[nH]c(=CC(C)C)c(=O)n(O)c1=O |w:3.2,7.7|

CC(C)C=c1[nH]c(=Cc2ccc(F)cc2)c(=O)[nH]c1=O |w:7.7,3.2|

CC(C)C=c1[nH]c(=Cc2ccc(F)cc2)c(=O)n(O)c1=O |w:7.7,3.2|

CC(C)C=c1[nH]c(=Cc2cccc(F)c2)c(=O)n(O)c1=O |w:3.2,7.7|

CC(C)C=c1[nH]c(=Cc2ccccc2)c(=O)n(O)c1=O |w:3.2,7.7|

CC(C)C=c1[nH]c(=Cc2ccccc2F)c(=O)n(O)c1=O |w:3.2,7.7|

CC(C)CNCc1cc(=O)c(O)co1

CC(C)N1CN(C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2C1=O

CC(C)N1C[C@H](C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2C1=O |r|

CC(C)NCc1cc(=O)c(O)co1

CC(C)c1cccc(c1)-c1cc(=O)c(O)c([nH]1)C(O)=O

CC(C)c1ccccc1-c1cc(=O)c(O)c([nH]1)C(O)=O

CC(C)n1cc(O)c(=O)cc1C

CC(N)C12CC3CC(CC(C3)C1)C2 |TLB:10:5:12:9.8.11,10:9:12:6.5.4,THB:4:5:8:12.3.11,4:3:6.5.10:8,1:3:6.5.10:8|

CC(NC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1)c1ccccc1

CC1(C)N(C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2-c2nccn12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)C=Cc3ccccc3Cl)ccc12 |w:16.16|

CCC(=O)c1c(O)n(O)c2cc(NC(=O)Nc3ccc(Cl)cc3)ccc12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)Nc3cccc(c3)C(O)=O)ccc12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)Nc3ccccc3)ccc12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)Nc3ccccc3Cl)ccc12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)c3ccc(Cl)cc3Cl)ccc12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)c3cccs3)ccc12

CCC(=O)c1c(O)n(O)c2cc(NC(=O)c3cnc4ccccc4n3)ccc12

CCC(C)CNC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1

CCC1N(C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2-c2nccn12

CCCCCCNC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1

CCCCNC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1

CCN1CCC[C@H]1CNC(=O)c1c(OC)c(CC)cc(OC)c1OC |r|

CCOC(=O)c1c(C)n(cc(O)c1=O)-c1ccc(Oc2ccccc2)cc1

CCOC(=O)c1c(C)n(cc(O)c1=O)-c1ccc(cc1)-c1nnn[nH]1

CCOC(=O)c1c(C)n(cc(O)c1=O)-c1ccccc1

CCOC(=O)c1c(O)c2cc(OC)ccc2n(C)c1=O

CCOC(=O)c1cn2[C@H](CN(CCOC)C(=O)c2c(O)c1=O)C(c1ccccc1)c1ccccc1 |r|

CCc1ccccc1-c1cc(=O)c(O)c([nH]1)C(O)=O

CCc1oc2ccccc2c1C(=O)c1cc(Br)c(O)c(Br)c1

CN(C)Cc1cc(=O)c(O)co1

CN(Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1nnn[nH]1)c1ccc(Cl)cc1

CN(Cc1cc(=O)c(O)co1)c1ccc(Cl)cc1

CN(Cc1cc(=O)c(O)co1)c1ccc(F)cc1

CN(Cc1cc(=O)c(O)co1)c1cccc(Cl)c1

CN(Cc1cc(=O)c(O)co1)c1cccc(F)c1

CN(Cc1cc(=O)c(O)co1)c1ccccc1

CN(Cc1cc(=O)c(O)co1)c1cccnc1

CN(Cc1cc(=O)c(O)co1)c1ccncc1

CN(Cc1ccccc1)Cc1cc(=O)c(O)co1

CN1CCC(CC1)n1cc(O)c(=O)cc1C

CN1CCc2cc(O)c(O)cc2C1Cc1ccc(O)c(O)c1

CN1CN(C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2C1=O

CN1C[C@H](C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2C1=O |r|

CNC(=O)c1c(C)occ(O)c1=O

CNC(=O)c1cccc(Nc2nc(O)nc(O)c2C#N)c1

CNC(=O)c1cn2[C@H](CN(CCOC)C(=O)c2c(O)c1=O)C(c1ccccc1)c1ccccc1 |r|

CNS(=O)(=O)c1ccc(cc1)-n1cc(O)c(=O)cc1C

COC(=O)C(=O)CC(=O)c1ccccc1

COC(=O)[C@@H]1Cc2cc(O)c(O)cc2[C@H](Cc2ccc(O)c(O)c2)N1C(=O)C(F)(F)F |r|

COC(=O)[C@@H]1Cc2cc(O)c(O)cc2[C@H](Cc2ccc(O)c(O)c2)N1C(C)=O |r|

COC(=O)[C@@H]1Cc2cc(O)c(O)cc2[C@H](Cc2ccc(O)c(O)c2)N1C=O |r|

COC(=O)c1ccc(cc1)-n1cc(O)c(=O)cc1C

COC(=O)c1cccc(c1)-n1cc(O)c(=O)cc1C

COC(=O)c1nc([nH]c(=O)c1O)-c1ccccn1

COC(=O)c1nc([nH]c(=O)c1O)-c1cn(C)cn1

COC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1

COCCN1CCn2cc(C(O)=O)c(=O)c(O)c2C1=O

COCCN1CN(C(c2ccccc2)c2ccccc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O

COCCN1CN(C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2C1=O

COCCN1CN(Cc2ccc(F)cc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O

COCCN1C[C@@H](Cc2ccccc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(C)C)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(c2ccccc2)c2ccccc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(c2ccccc2)c2ccccc2)n2cc(C)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(c2ccccc2)c2ccccc2)n2cc(Cl)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(c2ccccc2)c2ccccc2)n2cc(N)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(c2ccccc2)c2ccccc2)n2cc(OC)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](C(c2ccccc2)c2ccccc2)n2ccc(=O)c(O)c2C1=O |r|

COCCN1C[C@H](CC(C)C)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](CCc2ccccc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](Cc2ccccc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCCN1C[C@H](c2ccccc2)n2cc(C(O)=O)c(=O)c(O)c2C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@@H](O)c2ccccc2F)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@H](O)C(C)C)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@H](O)c2ccc(F)cc2)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@H](O)c2ccc(OC)cc2)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@H](O)c2cccc(F)c2)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@H](O)c2ccccc2)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)[C@@H]([C@H](O)c2ccccc2F)C1=O

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C/C(C)C)C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C/c2ccc(F)cc2)C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C/c2ccc(OC)cc2)C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C/c2cccc(F)c2)C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C/c2ccccc2)C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C/c2ccccc2F)C1=O |r|

COCON1C(=O)[C@H](CC(C)C)N(Cc2ccccc2)\C(=C\C(C)C)C1=O |r|

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)[C@@H]([C@@H](O)C(C)C)C1=O

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)[C@@H]([C@H](O)C(C)C)C1=O

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)[C@@H]([C@H](O)c2ccc(F)cc2)C1=O

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)[C@@H]([C@H](O)c2ccc(OC)cc2)C1=O

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)\C(=C/C(C)C)C1=O |r|

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)\C(=C/c2ccc(F)cc2)C1=O |r|

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)\C(=C/c2ccc(OC)cc2)C1=O |r|

COCON1C(=O)[C@H](Cc2ccccc2)N(Cc2ccccc2)\C(=C\C(C)C)C1=O |r|

COCOn1c(=O)c(=CC(C)C)[nH]c(=CC(C)C)c1=O |w:8.8,14.14|

COCOn1c(=O)c(=CC(C)C)[nH]c(=Cc2ccc(F)cc2)c1=O |w:8.8,14.14|

COCOn1c(=O)c(=CC(C)C)[nH]c(=Cc2ccc(OC)cc2)c1=O |w:8.8,14.14|

COCOn1c(=O)c(=CC(C)C)[nH]c(=Cc2cccc(F)c2)c1=O |w:8.8,14.14|

COCOn1c(=O)c(=CC(C)C)[nH]c(=Cc2ccccc2)c1=O |w:14.14,8.8|

COCOn1c(=O)c(=CC(C)C)[nH]c(=Cc2ccccc2)c1=O |w:8.8,14.14|

COCOn1c(=O)c(=CC(C)C)[nH]c(=Cc2ccccc2F)c1=O |w:8.8,14.14|

COCOn1c(=O)c(=Cc2ccccc2)[nH]c(=Cc2ccc(F)cc2)c1=O |w:8.8,17.18|

COCOn1c(=O)c(=Cc2ccccc2)[nH]c(=Cc2ccc(OC)cc2)c1=O |w:8.8,17.18|

COCc1cnc2-c3c(O)c(=O)ccn3[C@H](Cn12)C(c1ccccc1)c1ccccc1 |r|

CON1C(=O)Cc2ccccc2C1=O

COc1cc2nc(nc(N)c2cc1OC)N1CCOCC1

COc1ccc(C=c2[nH]c(=CC(C)C)c(=O)n(O)c2=O)cc1 |w:10.10,6.5|

COc1ccc(C=c2[nH]c(=Cc3ccccc3)c(=O)n(O)c2=O)cc1 |w:10.10,6.5|

COc1ccc(CNC(=O)c2c(C)occ(O)c2=O)cc1

COc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2cnccn2)cc1

COc1ccc(cc1)-n1cc(O)c(=O)cc1C

COc1ccc(cc1)C(=O)CC(=O)C(O)=O

COc1ccc(cc1)N(C)Cc1cc(=O)c(O)co1

COc1ccc(cc1)N1CCN=C1c1ccc(cc1)C1=NCCN1 |c:12,t:22|

COc1ccc(cc1)N1CCN=C1c1ccc(cc1)C1=NCCN1c1ccc(OC)cc1 |c:12,t:22|

COc1ccc2C(=O)C(Cc2c1)C(=O)C(O)=O

COc1cccc(CNC(=O)c2c(C)occ(O)c2=O)c1

COc1cccc(c1)-n1cc(O)c(=O)cc1C

COc1cccc(c1)N(C)Cc1cc(=O)c(O)co1

COc1ccccc1-c1cc(=O)c(O)c([nH]1)C(O)=O

CS(=O)(=O)NCc1cc(=O)c(O)co1

CSc1ccccc1-c1cc(=O)c(O)c([nH]1)C(O)=O

C[C@@H](NC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1)C1CCCCC1

C[C@@H](NC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1)c1ccc(C)cc1

C[C@@H](NC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1)c1ccccc1

C[C@H](NC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1)c1ccccc1

Cc1[nH]nc2oc(=O)cc(C)c12

Cc1c(C(O)=O)c(=O)c(O)cn1-c1ccccc1

Cc1c(O)c(=O)ccn1-c1ccccc1

Cc1c(O)c(=O)ccn1C1CCCCC1

Cc1cc(=O)c(O)c(CO)o1

Cc1cc(=O)c(O)c([nH]1)C(O)=O

Cc1cc(=O)c(O)cn1-c1ccc(Oc2ccccc2)cc1

Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1ccccc1

Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1nnn[nH]1

Cc1cc(=O)c(O)cn1-c1ccc(cc1)-n1cncn1

Cc1cc(=O)c(O)cn1-c1ccc(cc1)C(O)=O

Cc1cc(=O)c(O)cn1-c1ccc(cc1)N1CCOCC1

Cc1cc(=O)c(O)cn1-c1cccc(Oc2ccccc2)c1

Cc1cc(=O)c(O)cn1-c1cccc(c1)C(O)=O

Cc1cc(=O)c(O)cn1-c1ccccc1

Cc1cc(=O)c(O)cn1C

Cc1cc(=O)c(O)cn1C1CCCCC1

Cc1cc(=O)c(O)cn1C1CCN(CC1)S(C)(=O)=O

Cc1cc(=O)c(O)cn1C1CCOCC1

Cc1cc(=O)c(O)cn1Cc1ccc(cc1)-c1ccccc1

Cc1cc(=O)c(O)cn1Cc1ccccc1

Cc1cc(=O)c(O)co1

Cc1cc(C)c(C(=O)CC(=O)C(O)=O)c(C)c1

Cc1cc(NC(=O)c2c(O)nc(O)[nH]c2=O)no1

Cc1cc(ccc1-c1cc(=O)c(O)c([nH]1)C(O)=O)-c1nnn[nH]1

Cc1cc(ccc1-c1cc(=O)c(O)c([nH]1)C(O)=O)-c1noc(=O)[nH]1

Cc1cc(ccc1-c1cc(=O)c(O)c([nH]1)C(O)=O)C(O)=O

Cc1cc(no1)C(=O)Nc1ccc2c(C(=O)c3ccccc3)c(O)n(O)c2c1

Cc1ccc(CNC(=O)c2nc([nH]c(=O)c2O)-c2cnccn2)cc1

Cc1ccc(cc1)-c1cc(=O)c(O)c([nH]1)C(O)=O

Cc1cccc(c1)-c1cc(=O)c(O)c([nH]1)C(O)=O

Cc1cccc(c1)[C@@H]([C@H]1Cn2ccnc2-c2c(O)c(=O)cnn12)c1ccc(F)cc1 |r|

Cc1ccccc1-c1cc(=O)c(O)c([nH]1)C(O)=O

Cc1ccccc1C(=O)CC(=O)C(O)=O

Cc1ccccc1[C@@H]([C@H]1Cn2ccnc2-c2c(O)c(=O)cnn12)c1ccc(F)cc1 |r|

Cc1cccnc1-c1nc(C(O)=O)c(O)c(=O)[nH]1

Cc1nc(SCc2ccccc2)nc(O)c1CC(O)=O

Cc1nc2-c3c(O)c(=O)ccn3[C@H](Cn2c1C)C(c1ccccc1)c1ccccc1 |r|

Cc1occ(O)c(=O)c1C(=O)NCCc1c[nH]c2ccccc12

Cc1occ(O)c(=O)c1C(=O)NCCc1ccc(F)cc1

Cc1occ(O)c(=O)c1C(=O)NCCc1ccccc1

Cc1occ(O)c(=O)c1C(=O)NCc1ccc(F)cc1

Cc1occ(O)c(=O)c1C(=O)NCc1ccccc1

Cc1occ(O)c(=O)c1C(=O)Nc1ccc(F)cc1

Cc1occ(O)c(=O)c1C(=O)Nc1cccc2ccccc12

Cc1occ(O)c(=O)c1C(=O)Nc1ccccc1

Cc1occ(O)c(=O)c1C(O)=O

Cc1occc(=O)c1O

Clc1ccc(cc1)C(C#N)c1c(Cl)cc(cc1Cl)-n1ncc(=O)[nH]c1=O

Clc1ccc(cc1)N1CCN=C1c1ccc(cc1)C1=NCCN1c1ccc(Cl)cc1 |c:11,t:21|

Cn1c(CC(=O)C(O)=O)nc2ccccc12

Cn1c(nc(C(O)=O)c(O)c1=O)-c1ccccn1

Cn1cc(C(O)=O)c(=O)c2NCC=Cc12 |c:12|

Cn1cc(O)c(=O)cc1CO

Cn1cnc(c1)-c1nc(C(O)=O)c(O)c(=O)[nH]1

FC(F)(F)c1ccc(nc1)N1CCN=C1c1ccc(cc1)C1=NCCN1c1ccc(cn1)C(F)(F)F |c:14,t:24|

Fc1ccc(cc1)N1CCN=C1c1ccc(cc1)C1=NCCN1 |c:11,t:21|

Fc1ccc(cc1)N1CCN=C1c1ccc(cc1)C1=NCCN1c1ccc(F)cc1 |c:11,t:21|

NC(=O)C(=O)CC(=O)C1CCCCC1

NC(=O)C(\O)=C\C(=O)C1CCCCC1

NN1C(=O)Cc2ccccc2C1=O

NS(=O)(=O)c1ccc(cc1)C(=O)NCCc1ccc(O)c(O)c1

O=C1N\C(S\C1=C1/C(=O)Nc2ccccc12)=N/N=C1/C(=O)Nc2ccccc12

OC(=O)C(=O)C1COc2ccccc2C1=O

OC(=O)C(=O)CC(=O)C1(Cc2ccc(Cl)cc2)CCCN(C1)S(=O)(=O)Cc1ccccc1

OC(=O)C(=O)CC(=O)C1(Cc2ccc(Cl)cc2)CCCN(Cc2ccccc2)C1

OC(=O)C(=O)CC(=O)C1(Cc2ccc(Cl)cc2)CCN(CC1)C(=O)c1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12 |(18.46,-2.91,;17.13,-3.68,;17.13,-5.22,;15.79,-2.91,;15.79,-1.37,;14.46,-3.68,;13.13,-2.91,;13.13,-1.37,;11.79,-3.68,;12.73,-4.9,;12.73,-6.44,;11.4,-7.21,;11.4,-8.75,;12.73,-9.52,;12.73,-11.06,;14.06,-8.75,;14.06,-7.21,;10.86,-4.9,;9.33,-4.7,;8.74,-3.28,;9.68,-2.06,;11.2,-2.26,;7.21,-3.08,;6.28,-4.3,;6.62,-1.66,;7.56,-.43,;6.97,.99,;5.44,1.19,;4.51,-.03,;5.1,-1.45,;2.97,-.03,;1.54,.56,;3.17,-1.56,;4.86,2.61,;5.79,3.83,;7.32,3.63,;8.26,4.86,;7.67,6.28,;8.61,7.5,;6.14,6.48,;5.2,5.26,;3.68,5.46,;2.74,4.24,;1.21,4.44,;.28,3.22,;-1.25,3.42,;.86,1.79,;2.39,1.59,;3.33,2.81,)|

OC(=O)C(=O)CC(=O)C1(Cc2ccc(Cl)cc2)CCN(CC2CCCCC2)CC1

OC(=O)C(=O)CC(=O)C1(Cc2ccc(Cl)cc2)CCN(Cc2ccc(Cl)cc2)CC1

OC(=O)C(=O)CC(=O)C1(Cc2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1

OC(=O)C(=O)CC(=O)C1CCCCC1

OC(=O)C(=O)CC(=O)c1ccc(OCc2ccccc2)cc1

OC(=O)C(=O)CC(=O)c1ccc(Oc2ccccc2)cc1

OC(=O)C(=O)CC(=O)c1ccc(cc1)-c1ccccc1

OC(=O)C(=O)CC(=O)c1ccc(cc1)C1CCCCC1

OC(=O)C(=O)CC(=O)c1ccc(cc1)N1CCNCC1

OC(=O)C(=O)CC(=O)c1ccccc1

OC(=O)C(=O)CC(=O)c1cccnc1

OC(=O)C(=O)CCc1ccccc1

OC(=O)C(=O)CS(=O)(=O)c1ccccc1

OC(=O)C(=O)Cc1cc2ccccc2o1

OC(=O)C(=O)Cc1nc2ccccc2o1

OC(=O)C(=O)Cc1nc2ccccc2s1

OC(=O)C(\O)=C\C(=O)C1(Cc2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1

OC(=O)C(\O)=C\C(=O)C1CCCCC1

OC(=O)C1C(C(C(C(C1C(O)=O)C(O)=O)C(O)=O)C(O)=O)C(O)=O |(1.06,-3.7,;-0,-3.08,;-1.07,-3.7,;,-1.54,;1.33,-.77,;1.33,.77,;,1.54,;-1.33,.77,;-1.33,-.77,;-2.67,-1.54,;-3.73,-.93,;-2.66,-2.78,;-2.67,1.54,;-2.67,2.77,;-3.74,.92,;-0,3.08,;1.06,3.7,;-1.07,3.7,;2.67,1.54,;3.73,.93,;2.66,2.78,;2.67,-1.54,;3.73,-.93,;2.66,-2.78,)|

OC(=O)CC1N(CCCc2ccccc2)CCNC1=O

OC(=O)CCC(=O)c1ccccc1

OC(=O)CCc1nn2c(nc3ccccc23)nc1O

OC(=O)CCc1nnc(SCc2ccc(Cl)cc2)nc1O

OC(=O)\C=C\C(=O)c1ccccc1

OC(=O)c1[nH]c(cc(=O)c1O)-c1ccc(Oc2ccccc2)cc1

OC(=O)c1[nH]c(cc(=O)c1O)-c1ccc(cc1)-c1nnn[nH]1

OC(=O)c1[nH]c(cc(=O)c1O)-c1ccc(cc1C(F)(F)F)-c1nnn[nH]1

OC(=O)c1[nH]c(cc(=O)c1O)-c1cccc(Oc2ccccc2)c1

OC(=O)c1[nH]c(cc(=O)c1O)-c1cccc(c1)-c1nnn[nH]1

OC(=O)c1[nH]c(cc(=O)c1O)-c1ccccc1

OC(=O)c1[nH]c(cc(=O)c1O)-c1ccccc1C(F)(F)F

OC(=O)c1[nH]c(cc(=O)c1O)-c1ccccc1Oc1ccccc1

OC(=O)c1ccc(cc1)-c1cc(=O)c(O)c([nH]1)C(O)=O

OC(=O)c1ccc2cccnc2c1O

OC(=O)c1cccc(NC(=O)Nc2ccc3c(C(=O)c4ccccc4)c(O)n(O)c3c2)c1

OC(=O)c1cccc(c1)-c1cc(=O)c(O)c([nH]1)C(O)=O

OC(=O)c1ccccc1O

OC(=O)c1cn(CC2(CCCC2)n2ccc3cccnc23)cc(O)c1=O

OC(=O)c1nc([nH]c(=O)c1O)-c1ccccn1

OC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1

OC(=O)c1nc2-c3ncccc3Cn2c(=O)c1O

OC(=O)c1nccnc1C(=O)Nc1nc(n[nH]1)-c1cccs1

OC(=O)c1occc(=O)c1O

OC(CC(=O)c1ccccc1)C(O)=O

OC[C@@H](NC(=O)c1nc([nH]c(=O)c1O)-c1cnccn1)c1ccccc1

OCc1cc(=O)c(O)co1

OCc1cnc2-c3c(O)c(=O)ccn3[C@H](Cn12)C(c1ccccc1)c1ccccc1 |r|

ON1C(=O)C(Cc2ccccc2)NC(Cc2ccc(F)cc2)C1=O

ON1C(=O)CCc2ccccc2C1=O

ON1C(=O)Cc2ccccc2C1=O

ON1C(=O)Cc2ccccc2CC1=O

ON1C(=O)c2ccccc2C1=O

ON1Cc2ccccc2CC1=O

ONC(=O)c1ccccc1

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)C3CCCCC3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)NC3CCCCC3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)Nc3ccccc3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)\C=C\c3ccccc3Cl)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)c3ccc4ccccc4c3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)c3ccccc3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)c3cccs3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NC(=O)c3cnc4ccccc4n3)cc2n1O

Oc1c(C(=O)c2ccccc2)c2ccc(NS(=O)(=O)c3cccs3)cc2n1O

Oc1c(C=O)cc(Cc2ccccc2Cl)cc1[N+]([O-])=O

Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NC1CCCCC1

Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NC1CCCc2ccccc12

Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NCC1CC1

Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NCCc1ccccc1

Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NCc1ccc(F)cc1

Oc1c(nc([nH]c1=O)-c1cnccn1)C(=O)NCc1ccccc1

Oc1c2-c3ncc(-c4ccccc4)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3ncc(-c4cn[nH]c4)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3ncc(Br)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3ncc(C(F)F)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3ncc(C4CC4)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3ncc(Cl)n3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3nccn3CC(C(c3cccc(F)c3)c3cccc(F)c3)n2ncc1=O

Oc1c2-c3nccn3CC(C(c3ccccc3)c3ccccc3)n2ncc1=O

Oc1c2-c3nccn3CN(C(c3ccccc3)c3ccccc3)n2ccc1=O

Oc1c2-c3nccn3C[C@H](C(c3cccc(F)c3)c3cccc(F)c3)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H](C(c3ccccc3)c3ccccc3)n2ccc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@@H](c3ccc(F)cc3)c3ccc(Cl)cc3)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@@H](c3ccc(F)cc3)c3cccc(Br)c3)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@@H](c3ccc(F)cc3)c3cccc(F)c3)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@@H](c3ccc(F)cc3)c3cccc(c3)C#N)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@@H](c3cccc(F)c3)c3cccc(c3)C#N)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@@H](c3ccccc3)c3ccc(F)cc3)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@H](c3ccc(F)cc3)c3ccc(F)cc3Br)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@H](c3ccc(F)cc3)c3ccc(nc3)C(F)(F)F)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@H](c3ccc(F)cc3)c3cncc(F)c3)n2ncc1=O |r|

Oc1c2-c3nccn3C[C@H]([C@H](c3ccccc3)c3ccc(F)cc3)n2ncc1=O |r|

Oc1c2-c3ncnn3CC(C(c3ccccc3)c3ccccc3)n2ncc1=O

Oc1c2C(=O)N(Cc3ccco3)CN(C(c3ccccc3)c3ccccc3)n2ccc1=O

Oc1cc(-c2ccc(cc2)-c2nnn[nH]2)c([nH]c1=O)-c1ccc(F)cc1

Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c1cc(O)c(O)c(O)c1 |r|

Oc1cc2[nH]cc(C(=O)C(=O)N3CCC(Cc4ccccc4)CC3)c2cc1O

Oc1cc2[nH]cc(C(=O)CCN3CCC(Cc4ccc(F)cc4)CC3)c2cc1O

Oc1cc2cc([nH]c2cc1O)C(=O)NCCCCNC(=O)c1cc2cc(O)c(O)cc2[nH]1

Oc1cc2cc([nH]c2cc1O)C(=O)NCCCNC(=O)c1cc2ccccc2[nH]1

Oc1cc2cc(ccc2oc1=O)-c1ccc(F)cc1

Oc1ccc(C(=O)COc2ccc(F)cc2)c(O)c1O

Oc1ccc(CCNC(=O)c2cc3cc(O)c(O)cc3[nH]2)cc1O

Oc1ccc(C[C@@H]2N(C=O)[C@@H](Cc3cc(O)c(O)cc23)C(=O)Oc2ccccc2)cc1O |r|

Oc1ccc(C[C@@H]2N(C=O)[C@@H](Cc3cc(O)c(O)cc23)C(=O)Oc2ccccc2Br)cc1O |r|

Oc1ccc(C[C@@H]2N(C=O)[C@@H](Cc3cc(O)c(O)cc23)C(=O)Oc2ccccc2Cl)cc1O |r|

Oc1ccc(C[C@@H]2N(C=O)[C@@H](Cc3cc(O)c(O)cc23)C(=O)Oc2ccccc2F)cc1O |r|

Oc1ccc(\C=N\Nc2ccc(Cl)cc2)c(O)c1O

Oc1coc(CN2CCCCC2)cc1=O

Oc1coc(CNC(=O)c2ccccc2)cc1=O

Oc1coc(CNC2CCCCC2)cc1=O

Oc1coc(CNCc2ccccc2)cc1=O

Oc1coc(CNS(=O)(=O)c2ccccc2)cc1=O

Oc1coc(CNc2ccccc2)cc1=O

Oc1coc(COc2ccccc2)cc1=O

Oc1coccc1=O

On1c(=O)[nH]c2nccnc2c1=O

On1c(=O)c(=Cc2ccccc2)[nH]c(=Cc2ccc(F)cc2)c1=O |w:14.15,5.5|

On1c(=O)c(=Cc2ccccc2)[nH]c(=Cc2ccc(F)cc2)c1=O |w:5.5,14.15|

On1cnc2nccnc2c1=O

[H][C@@]1(CC[C@@]2([H])[C@]3([H])CCC4=CC(=O)CCC4=C3C=C[C@]12C)OC(C)=O |c:17,20,t:10|

[NH3+][C@@H](CC(=O)c1ccccc1)C([O-])=O

[O-]C(=O)C(=O)[CH-]C(=O)C1(Cc2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1

[O-][N+](=O)c1ccc(NNC(=O)CC(=O)Nc2ccccc2)cc1