Compound Name

SMILES String

CC(=O)NCCc1ccc(c(c1)c2c(c3c(c(c2O)O)C(=O)c4cc(c(c(c4C3=O)C(=O)O)C(=O)O)O)O)O

Cc1ccn2c(CCc3nnc4cc(C)ccn34)nnc2c1

OC(=O)C(Cc1c[nH]c2ccccc12)N1C(=O)c2ccccc2C1=O

COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)ccc1O |w:6.6,13.13|

COc1cc(C=CC(=O)CC(=O)C=Cc2ccc(O)c(OC)c2)ccc1O |w:12.11,5.4|

Oc1ccc(C=CC(=O)CC(=O)C=Cc2ccc(O)cc2)cc1 |w:12.11,5.4|

CC(=O)OCc1cnc(=O)[nH]c1NCc1ccccc1

c1cc(oc1)CNC2=CC=NC(=O)N2

CCC=Nc1ccnc(=O)[nH]1 |w:3.3|

CCNc1cc[nH]c(=O)n1

CCCCNc1ccnc(=O)[nH]1

CC=Nc1ccnc(=O)[nH]1 |w:1.0|

O=C1NCNC(NCc2ccco2)=N1 |c:13|

Cc1cnc(=O)[nH]c1NCc1ccccc1

O=C1NCNC(NCc2ccccc2)=N1 |c:14|

O=Cc1cnc(=O)[nH]c1NCc1ccccc1

OS(=O)(=O)Cc1cnc(=O)[nH]c1NCc1ccccc1

OCc1cnc(=O)[nH]c1NCc1ccccc1

O=c1nccc(NCc2cccnc2)[nH]1

Cc1ccc(CNc2ccnc(=O)[nH]2)cc1

O=c1nccc(NCc2ccccc2)[nH]1

Cc1ccc(cc1)S(=O)(=O)Nc1ccnc(=O)[nH]1

c1c(cc(c(c1O)O)O)[C@@H]2[C@@H](Cc3c(cc(cc3O2)O)O)OC(=O)c4cc(c(c(c4)O)O)O

OC(=O)[C@H](Cc1c[nH]c2ccccc12)N1C(=O)c2ccccc2C1=O

Cc1cnc(=O)[nH]c1NCc1ccco1

Cc1cn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)nc1NCc1ccco1 |r|

CCCCNCc1cnc(=O)[nH]c1NCc1ccco1

O=Cc1cnc(=O)[nH]c1NCc1ccco1

OS(=O)(=O)Cc1cnc(=O)[nH]c1NCc1ccco1

CC(=O)OCc1cnc(=O)[nH]c1NCc1ccco1

OCc1cnc(=O)[nH]c1NCc1ccco1

OC[C@H]1O[C@H](C[C@@H]1O)n1ccc(NCc2ccco2)nc1=O |r|

CCCC=Nc1ccnc(=O)[nH]1 |w:4.4|

[O-][N+](=O)c1ccccc1CNc1ccnc(=O)[nH]1

C1=NC(=O)NC(=N1)N

OCc1ccc(CNc2ccnc(=O)[nH]2)o1