Molecule ID: mol10164
SMILES: COc1cc(O)ccc1[N+](=O)[O-]
InChI: InChI=1S/C7H7NO4/c1-12-7-4-5(9)2-3-6(7)8(10)11/h2-4,9H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.10 | QSARToolbox | 0 » -1 |
| 6.10 | IUPAC digitized pKa | 0 » -1 |
| 6.10 | OCHEM | 0 » -1 |
| 6.10 | AttenGpKa training set | 0 » -1 |