Molecule ID: mol14259
SMILES: O=C(O)c1ccc([N+](=O)[O-])o1
InChI: InChI=1S/C5H3NO5/c7-5(8)3-1-2-4(11-3)6(9)10/h1-2H,(H,7,8)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.06 | OCHEM | 0 » -1 |
| 2.06 | QSARToolbox | 0 » -1 |
| 2.06 | Datawarrior | 0 » -1 |
| 2.06 | AttenGpKa training set | 0 » -1 |