Molecule ID: mol34362
SMILES: Cc1c([N+](=O)[O-])c(O)c([N+](=O)[O-])c(C(C)C)c1[N+](=O)[O-]
InChI: InChI=1S/C10H11N3O7/c1-4(2)6-7(11(15)16)5(3)8(12(17)18)10(14)9(6)13(19)20/h4,14H,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.50 | QSARToolbox | 0 » -1 |
| 3.50 | QSARToolbox | 0 » -1 |