Compound Name

SMILES String

c1cnc(cc1C(=O)O)C(=O)O

CC(C)c1c(O)c(O)c(C=O)c2c(O)c(c(C)cc12)-c1c(C)cc2c(C(C)C)c(O)c(O)c(C=O)c2c1O |(-4.44,-1.63,;-5.78,-.86,;-7.11,-1.63,;-5.78,.68,;-7.11,1.45,;-8.44,.68,;-7.11,2.99,;-8.44,3.76,;-5.78,3.76,;-5.78,5.3,;-4.44,6.07,;-4.44,2.99,;-3.11,3.76,;-3.11,5.3,;-1.77,2.99,;-1.77,1.45,;-.44,.68,;-3.11,.68,;-4.44,1.45,;-.44,3.76,;-.44,5.3,;-1.77,6.07,;.89,6.07,;2.23,5.3,;3.56,6.07,;3.56,7.61,;4.89,8.38,;2.23,8.38,;4.89,5.3,;6.23,6.07,;4.89,3.76,;6.23,2.99,;3.56,2.99,;3.56,1.45,;4.89,.68,;2.23,3.76,;.89,2.99,;.89,1.45,)|

[H][C@](NC(=O)c1nc(nc(N)c1C)[C@H](CC(N)=O)NC[C@H](N)C(N)=O)([C@@H](O[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O[C@H]1O[C@H](CO)[C@@H](O)[C@H](OC(N)=O)[C@@H]1O)c1c[nH]cn1)C(=O)N[C@H](C)[C@@H](O)[C@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCCc1nc(cs1)-c1nc(cs1)C(=O)NCCC[S+](C)C |r|

CC1(CCC(=C(C1)c2ccc(cc2)Cl)CN3CCN(CC3)c4ccc(c(c4)Oc5cc6cc[nH]c6nc5)C(=O)NS(=O)(=O)c7ccc(c(c7)[N+](=O)[O-])NCC8CCOCC8)C

c1ccc(cc1)NS(=O)(=O)c2cccc(c2)/C=C/C(=O)NO

C[C@@]12[C@@H]([C@@H](C[C@@H](O1)n3c4ccccc4c5c3c6n2c7ccccc7c6c8c5C(=O)NC8)N(C)C(=O)c9ccccc9)OC

OCc1ccc(cc1)[C@@H]1C[C@H](CSc2nc(c(o2)-c2ccccc2)-c2ccccc2)O[C@@H](O1)c1ccc(NC(=O)CCCCCCC(=O)NO)cc1 |r|

CC1(CCC(=C(C1)CN2CCN(CC2)c3ccc(cc3)C(=O)NS(=O)(=O)c4ccc(c(c4)S(=O)(=O)C(F)(F)F)N[C@H](CCN5CCOCC5)CSc6ccccc6)c7ccc(cc7)Cl)C

COc1cc([nH]c1=C/c1[nH]c(C)cc1C)=C1/C=c2ccccc2=N1

CCCS(=O)(=O)Nc1ccc(F)c(C(=O)c2c[nH]c3ncc(cc23)-c2ccc(Cl)cc2)c1F

CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|

Cc1c(cc2cc3c(c(c2c1O)O)C(=O)[C@H]([C@@H](C3)[C@@H](C(=O)[C@H]([C@@H](C)O)O)OC)O[C@H]4C[C@H]([C@@H]([C@H](O4)C)O)O[C@H]5C[C@H]([C@H]([C@H](O5)C)O)O[C@H]6C[C@]([C@@H]([C@H](O6)C)O)(C)O)O[C@H]7C[C@H]([C@@H]([C@H](O7)C)O)O[C@H]8C[C@H]([C@@H]([C@H](O8)C)O)O

CCC(Nc1c(ccnc1C(O)=O)C(O)=O)c1ccccc1

OC(=O)c1ccnc(C(O)=O)c1Nc1ccccc1[N+]([O-])=O

OC(=O)c1ccnc(C(O)=O)c1NCc1ccccc1

OC(=O)c1ccnc(C(O)=O)c1NCC1CCCCC1

COc1ccc(CNc2c(ccnc2C(O)=O)C(O)=O)cc1

OC(=O)c1ccnc(C(O)=O)c1NCc1ccc(cc1)C(F)(F)F

CC(Nc1c(ccnc1C(O)=O)C(O)=O)c1ccccc1

OC(=O)c1ccnc(C(O)=O)c1NCCc1ccccc1

OC(=O)c1ccnc(C(O)=O)c1NCCCc1ccccc1

OC(=O)c1ccnc(C(O)=O)c1NCCCCc1ccccc1

c1cnc(c(c1C(=O)O)F)C(=O)O

OC(=O)c1ccnc(C(O)=O)c1C(F)(F)F

c1c(c(cnc1C(=O)O)F)C(=O)O

OC(=O)c1cc(C(O)=O)c(cn1)C(F)(F)F

c1ccc(cc1)CNc2cnc(cc2C(=O)O)C(=O)O

OC(=O)c1cc(C(O)=O)c(NCCc2ccccc2)cn1

OC(=O)c1cc(C(O)=O)c(NCCCc2ccccc2)cn1

c1ccc(cc1)CCCCNc2cnc(cc2C(=O)O)C(=O)O

CC(Nc1cnc(cc1C(O)=O)C(O)=O)c1ccccc1

OC(=O)c1cc(C(O)=O)c(NCC2CCCCC2)cn1

OC(=O)c1cc(C(O)=O)c(NCc2ccc(cc2)C(F)(F)F)cn1

COc1ccc(cc1)CNc2cnc(cc2C(=O)O)C(=O)O

COc1ccccc1CNc2cnc(cc2C(=O)O)C(=O)O

c1ccc(c(c1)CNc2cnc(cc2C(=O)O)C(=O)O)C3CC3

Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1Nc1nc(-c2cccnc2)nc2c1cnn2C