Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol12741 O=C1CC(=O)c2ccccc2O1 2 2
mol12742 O=C(O)c1coc2ccccc12 2 2
mol12743 O=C(O)c1cc2ccccc2o1 2 2
mol12744 O=C(O)C1Cc2ccccc2O1 2 2
mol12745 O=C(O)C[C@]1(O)C[C@@H]2C=C[C@H]1C2 2 2
mol12746 O=C(O)C[C@]1(O)C[C@H]2C=C[C@@H]1C2 2 2
mol12747 O=C(O)C[C@]1(O)C[C@H]2CC[C@@H]1C2 2 2
mol12748 O=C(O)C[C@]1(O)C[C@@H]2CC[C@H]1C2 2 2
mol12749 O=c1ccc2ccc(O)cc2o1 2 2
mol12750 O=C(O)C12CCC(O)(CC1)CC2 2 2
mol12751 O=S1(=O)C=C(O)c2ccccc21 2 2
mol12752 Cc1cc(-c2ncc[nH]2)nn1C 3 4
mol12753 Cc1cccc(-c2nnn[nH]2)c1 2 2
mol12754 Cc1ccccc1-c1nnn[nH]1 2 2
mol12755 Cc1cc(-c2cc(C)n[nH]2)[nH]n1 3 3
mol12756 Cn1ccnc1-c1nccn1C 3 3
mol12757 Clc1cccc(-c2nnn[nH]2)c1 3 4
mol12758 Ic1ccc(-c2nnn[nH]2)cc1 3 4
mol12759 Brc1cccc(-c2nnn[nH]2)c1 2 2
mol12760 Brc1ccc(-c2nnn[nH]2)cc1 3 4