Browse Molecules

Molecule ID SMILES Charge States Microspecies
mol11821 N#CC(=CC=CC(C#N)=C(C#N)C#N)C(C#N)C#N 0 0
mol11822 O=C1C=C(O)c2cccc3cccc1c23 0 0
mol11823 O=C(c1cccc(O)c1)c1ccc(O)cc1O 4 8
mol11824 Oc1ccc(Cc2ccccc2O)cc1 3 4
mol11825 CC(C)C(=O)C1C(=O)c2ccccc2C1=O 0 0
mol11826 O=C(O)c1ccc(C23CCCC2C3)cc1 2 2
mol11827 COC(=O)CC(C)(Cc1ccccc1)C(=O)O 2 2
mol11828 CCC(CC(=O)OC)(C(=O)O)c1ccccc1 2 2
mol11829 CCC(CC(=O)O)(CC(=O)O)c1ccccc1 3 3
mol11830 CCC(CC(=O)O)(C(=O)OC)c1ccccc1 2 2
mol11831 COC(=O)C(C(C(=O)O)C(C)(C)C)C(C)(C)C 0 0
mol11832 CCC(CC)(C(=O)O)C(CC)(CC)C(=O)OC 2 2
mol11833 O=C(O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Nc1ccc([N+](=O)[O-])cc1 0 0
mol11834 O=C(O)c1ccccc1Nc1c([N+](=O)[O-])cc([N+](=O)[O-])cc1[N+](=O)[O-] 0 0
mol11835 O=C(O)c1cccc(Nc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])c1 0 0
mol11836 O=C(O)c1cc(N=Nc2ccccc2[N+](=O)[O-])ccc1O 2 2
mol11837 O=C(O)c1cc(N=Nc2cccc([N+](=O)[O-])c2)ccc1O 2 2
mol11838 O=C(O)c1cc(N=Nc2ccc([N+](=O)[O-])cc2)ccc1O 2 2
mol11839 O=C(O)c1cccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1 0 0
mol11840 O=C(O)c1ccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 0 0