Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol11161 Nc1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)n1 4 12
mol11162 CC(=O)OC(CC(=O)O)C[N+](C)(C)C 2 2
mol11163 CC[N+](C)(CC)CC(=NO)C(C)=O 2 2
mol11164 C[N+](C)(C)CCN(CC(=O)O)CC(=O)O 3 5
mol11165 Oc1cc(I)c(Cl)c2cccnc12 0 0
mol11166 Oc1ccc(N=Nc2ncc(Br)s2)c(O)c1 2 3
mol11167 O=S(=O)(O)c1cc(Cl)c2cccnc2c1O 3 4
mol11168 O=S(=O)(O)c1cc(Br)c2cccnc2c1O 3 4
mol11169 O=S(=O)(O)c1cc(I)c2cccnc2c1O 3 4
mol11170 N#CC(C#N)=C(C#N)NC(C#N)=C(C#N)C#N 0 0
mol11171 O=c1c(O)c(-c2ccccc2)c1=O 2 2
mol11172 O=C1C=C(O)C(=O)c2ccccc21 2 2
mol11173 O=c1c(O)c(-c2ccc(O)cc2)c1=O 3 3
mol11174 O=C(O)c1cc(C(=O)O)c(C(=O)O)cc1C(=O)O 5 7
mol11175 O=C(O)C=C=Cc1ccccc1 2 2
mol11176 O=C(O)CC#Cc1ccccc1 2 2
mol11177 O=C1CC(c2ccccc2)=C1O 2 3
mol11178 CC1C(=O)c2ccccc2C1=O 2 2
mol11179 Oc1cc(O)c2ccccc2c1 2 3
mol11180 Oc1cccc2cccc(O)c12 2 2