Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol801 Oc1ccccc1Cc1ccccc1O 3 3
mol802 Oc1ccc(Cc2ccc(O)cc2)cc1 3 3
mol803 CCOC(=O)c1cc(O)cc2ccccc12 2 2
mol804 O=C(O)c1ccc([C@@]23CCC[C@@H]2C3)cc1 2 2
mol805 CCc1ccc(O)c2c(CC)c(C)oc12 2 2
mol806 O=C(O)c1ccc(C2CCCCC2)cc1 2 2
mol807 COC(=O)C[C@](C)(Cc1ccccc1)C(=O)O 2 2
mol808 CC[C@](CC(=O)OC)(C(=O)O)c1ccccc1 2 2
mol809 CC[C@@](CC(=O)O)(C(=O)OC)c1ccccc1 2 2
mol810 COC(=O)[C@@H]([C@H](C(=O)O)C(C)(C)C)C(C)(C)C 2 2
mol811 O=C(O)c1c(F)c(F)c(-c2c(F)c(F)c(F)c(F)c2F)c(F)c1F 2 2
mol812 O=C(O)c1cc(/N=N/c2ccccc2)ccc1O 2 2
mol813 O=C(O)c1ccccc1/N=N/c1ccc(O)c(O)c1 2 4
mol814 S=C(Nc1ccccc1)c1ccccc1 2 2
mol815 CC[C@@](CC(=O)OC)(Cc1ccc([N+](=O)[O-])cc1)C(=O)O 2 2
mol816 COC(=O)C[C@](C)(Cc1ccc([N+](=O)[O-])cc1)C(=O)O 2 2
mol817 CC[C@@](CC(=O)O)(C(=O)OC)c1ccc([N+](=O)[O-])cc1 2 2
mol818 O=C(O)c1cc(/N=N/c2ccc(Cl)cc2)ccc1O 2 2
mol819 Cc1ccc(S(=O)(=O)Nc2ccccc2)cc1 2 2
mol820 Cc1ccc(NS(=O)(=O)c2ccccc2)cc1 2 2