Molecule ID: mol9356
SMILES: O=c1ccccn1O
InChI: InChI=1S/C5H5NO2/c7-5-3-1-2-4-6(5)8/h1-4,8H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.90 | IUPAC digitized pKa | 0 » -1 |
| 5.97 | QSARToolbox | 0 » -1 |
| 5.97 | QSARToolbox | 0 » -1 |
| 5.98 | IUPAC digitized pKa | 0 » -1 |
| 5.98 | Datawarrior | 0 » -1 |