Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol34942 CC1=CN([C@@H]2O[C@H](CO)[C@@H](OP(=O)(O)O)[C@H]2O)C(=O)N[C]1O 2 2
mol34943 CC1=CN([C@@H]2O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)N[C]1O 2 2
mol34944 CC1=C/C(=C(/c2ccccc2S(=O)(=O)O)c2cc(C)c(O)c(CN(CC(=O)O)CC(=O)O)c2C)C(C)=C(CN(CC(=O)O)CC(=O)O)C1=O 2 4
mol34945 CC1=C/C(=C(\c2cc(C)c(O)c(Br)c2)c2ccccc2S(=O)(=O)O)C=C(Br)C1=O 2 2
mol34946 CC1=C/C(=C(/c2ccc(O)c(C)c2)c2ccccc2S(=O)(=O)O)C=CC1=O 2 2
mol34947 CC1=NC(Cc2ccccc2)C(=O)O1 2 1
mol34948 CC1=NC2=CC=CC=C(C=C1)C2 2 2
mol34949 CC1=NN(c2nc(C)c(C)c(Cl)n2)C(=O)C1 2 2
mol34950 CC1=NN(c2nc(C)c(C)c(O)n2)C(=O)C1 2 3
mol34951 CC1=NN(c2nc(C)c(C)c(C#N)n2)C(=O)C1 2 2
mol34952 CC1=NN(c2nc(C)cc(O)n2)C(=O)C1 2 3
mol34953 CC1=NN(c2ccccc2)C(=O)C1C(=O)c1ccc2ccccc2c1 2 2
mol34954 CC1=NN(c2ccccc2)C(=O)C1C(=O)c1ccccc1C 2 2
mol34955 CC1=NN(c2ccccc2)C(=O)C1SC(=N)N 2 2
mol34956 CC1=Nc2nc(C)c(C)nc2C(O)N1 2 4
mol34957 CC1CC(=O)N(CCN2CCN(c3cccc4c3OCCO4)CC2)C1=O 2 2
mol34958 CC1CC(c2ccccn2)Nc2ccccc21 0 0
mol34959 CC1CCC/C(=C(/CC(=O)O)C(=O)O)C1 2 3
mol34960 CC1CC[C@@H](O)[C@H](N)C1 0 0
mol34961 CC1CN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)C1 2 8