Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol11941 CCCC(CC(=O)O)(CC(=O)O)c1ccccc1 3 3
mol11942 CC1N=C(C=C2CC(C)(C)CN2)CC1(C)C 0 0
mol11943 CCCCCCCCCCCCCC(=O)O 2 2
mol11944 O=C1c2ccccc2C(=O)c2c(O)c(S(=O)(=O)O)cc(O)c21 3 4
mol11945 O=C1c2ccccc2C(=O)c2c1cc(S(=O)(=O)O)c(O)c2O 3 4
mol11946 Oc1c(N=Nc2ccccn2)ccc2cccnc12 2 2
mol11947 O=C1c2ccccc2C(=O)C1Cc1cccs1 0 0
mol11948 O=C(O)c1ccccc1NC(=O)c1c(O)cccc1O 0 0
mol11949 O=C(O)c1ccc(NC(=O)c2c(O)cccc2O)cc1 0 0
mol11950 ON=C(C(=NO)c1ccccc1)c1ccccc1 2 2
mol11951 N#CC1C(=O)NC(=O)C12CCCc1ccccc12 0 0
mol11952 Cc1ccccc1N=Nc1ccc(O)c(C(=O)O)c1 4 6
mol11953 Cc1cccc(N=Nc2ccc(O)c(C(=O)O)c2)c1 2 2
mol11954 Cc1ccc(N=Nc2ccc(O)c(C(=O)O)c2)cc1 2 2
mol11955 Cc1ccc(O)c(N=Nc2ccccc2C(=O)O)c1 2 2
mol11956 COc1ccc(N=Nc2ccc(O)c(C(=O)O)c2)cc1 2 2
mol11957 O=[N+]([O-])C(C(c1ccccc1)c1ccccc1)[N+](=O)[O-] 2 2
mol11958 O=C(Cc1ccccc1)N(O)c1ccccc1 2 2
mol11959 Cc1ccc(C(=O)Nc2ccc(O)cc2)cc1 0 0
mol11960 Cc1ccccc1C(=O)N(O)c1ccccc1 2 2