Molecule ID: mol14587
SMILES: O=[N+]([O-])c1ccc(-c2ccc(O)cc2)cc1
InChI: InChI=1S/C12H9NO3/c14-12-7-3-10(4-8-12)9-1-5-11(6-2-9)13(15)16/h1-8,14H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.77 | QSARToolbox | 0 » -1 |
| 8.95 | QSARToolbox | 0 » -1 |
| 8.95 | QSARToolbox | 0 » -1 |
| 9.01 | Datawarrior | 0 » -1 |
| 9.01 | OCHEM | 0 » -1 |
| 9.07 | QSARToolbox | 0 » -1 |