Compound Name

SMILES String

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCC(=O)CCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCC(=O)NCCc1c[nH]c2CC=CCc12 |c:62|

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCC(=O)NCCc1c[nH]c2CC=CCc12 |c:63|

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCCCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1OC([C@@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)[C@@H](O)C(=O)NCCC(=O)NCCSCCC[NH2+]CCc1c[nH]c2ccccc12

BrCC(=O)NCCc1c[nH]c2ccccc12

COc1ccc2occ(CCNC(=O)CBr)c2c1

COc1ccc2scc(CCNC(=O)CBr)c2c1

BrCC(=O)NCCc1csc2ccccc12

BrCC(=O)NCCc1csc2ccc(Br)cc12

Fc1ccc2scc(CCNC(=O)CBr)c2c1

CCc1ccc2scc(CCNC(=O)CBr)c2c1

Oc1ccc2scc(CCNC(=O)CBr)c2c1

CC(C)(C)c1ccc(NC(=O)N2CCN(CC2)c2ncccc2Cl)cc1

CC(=O)n1c(O)c(-c2sc(=S)n(CCCCCC(O)=O)c2O)c2ccccc12 |(14.02,-32.05,;15.56,-32.07,;16.32,-33.41,;16.35,-30.75,;17.88,-30.9,;18.63,-32.23,;18.49,-29.5,;20.03,-29.5,;20.95,-30.74,;22.41,-30.26,;23.74,-31.03,;22.41,-28.72,;23.73,-27.92,;25.08,-28.65,;26.39,-27.85,;27.75,-28.58,;29.06,-27.78,;30.42,-28.52,;31.73,-27.72,;30.46,-30.06,;20.95,-28.24,;20.47,-26.78,;17.34,-28.47,;17.34,-26.92,;16.01,-26.16,;14.68,-26.92,;14.68,-28.47,;16.02,-29.25,)|

OC(=O)COc1ccc(\C=N\NC(=O)c2ccc(OCc3ccccc3)cc2)cc1

OC(=O)CCCCCn1c(O)c(sc1=S)C1C(=O)N(Cc2ccc(F)cc2)c2ccccc12 |w:15.16|

OC(=O)CCCCCn1c(O)c(sc1=S)C1C(=O)Nc2ccccc12 |w:15.16|

Oc1c(sc(=S)n1CCS(O)(=O)=O)C1C(=O)N(CC(=O)Nc2ccccc2)c2ccccc12 |w:13.14|

Cc1ccc(CN2C(=O)C(c3ccccc23)c2sc(=S)n(CCS(O)(=O)=O)c2O)cc1 |w:9.8|

OC(=O)CCCCCn1c(O)c(sc1=S)C1C(=O)N(CC=C)c2ccc(Br)cc12 |w:15.16|

CC(CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(=O)CCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCS[C@@H]1CCCCC1C(=O)CCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSCC(=O)NCCc1c[nH]c2ccccc12

CC(C)(CC(=O)CCCc1c[nH]c2ccccc12)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSCCC(=O)CCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSCCC(=O)NCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSC1CCCC1C(=O)CCCc1c[nH]c2ccccc12

CC(CC(=O)CCCc1c[nH]c2ccccc12)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)[C@H](O)C(=O)NCCC(=O)NCCSC=CC(=O)CCCc1c[nH]c2ccccc12 |w:49.52|

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSC=CC(=O)CCCc1c[nH]c2ccccc12 |w:49.52|

CCC(CSCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(=O)CCCc1c[nH]c2ccccc12

CC(C)(COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSCCC(O)CCCc1c[nH]c2ccccc12

CC(SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC1OC(C(O)C1OP([O-])([O-])=O)n1cnc2c(N)ncnc12)C(C)C(=O)CCCc1c[nH]c2ccccc12