Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol12161 CCCCCCCC(CCCCCCC)(C(=O)O)C(=O)O 2 2
mol12162 N#CC1C(=O)NC(=O)C12c1ccccc1-c1ccccc12 0 0
mol12163 O=C(O)c1cc(N=Nc2ccccc2[N+](=O)[O-])c2ccccc2c1O 2 2
mol12164 O=C(O)c1cc(N=Nc2cccc([N+](=O)[O-])c2)c2ccccc2c1O 2 2
mol12165 N#CC1C(=O)NC(=O)C1(c1ccccc1)c1ccccc1 2 3
mol12166 O=C(O)c1ccccc1N=Nc1c(O)ccc2ccccc12 2 2
mol12167 O=C(O)c1cc(N=Nc2ccccc2)c2ccccc2c1O 2 2
mol12168 CC(=O)Nc1ccc(C2C(=O)c3ccccc3C2=O)cc1 0 0
mol12169 CC1=NN(c2ccccc2)C(=O)C1C(=O)c1ccccc1 3 3
mol12170 NC(=O)C1C(=O)NC(=O)C1(c1ccccc1)c1ccccc1 2 4
mol12171 O=C1CC(Cc2ccccc2)(c2ccccc2)C(=O)N1 2 2
mol12172 CC(=O)C(Cc1ccccc1)C(=O)Nc1ccccc1 0 0
mol12173 CC(C)(C)c1cc([N+](C)(C)C)cc(C(C)(C)C)c1O 2 2
mol12174 O=C(O)c1cc(N=Nc2ccc(Cl)cc2)c2ccccc2c1O 2 2
mol12175 O=C(O)c1cc(N=Nc2ccc(I)cc2)c2ccccc2c1O 2 2
mol12176 N#Cc1ccc(N=Nc2ccc(O)c3ccc(S(=O)(=O)O)cc23)cc1 2 2
mol12177 O=S(=O)(O)c1ccc2c(N=Nc3nc4ccccc4s3)c(O)ccc2c1 2 2
mol12178 Nc1c(N=Nc2ccccc2C(=O)O)cc(S(=O)(=O)O)c2ccccc12 2 3
mol12179 Cc1ccc(N=Nc2ccc(O)c3ccc(S(=O)(=O)O)cc23)cc1 2 2
mol12180 CC(=O)NS(=O)(=O)c1ccc(N=Nc2ccc(O)c3ncccc23)cc1 2 2