Molecule ID: mol10138
SMILES: NC(=O)c1ccccc1O
InChI: InChI=1S/C7H7NO2/c8-7(10)5-3-1-2-4-6(5)9/h1-4,9H,(H2,8,10)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.49 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 7.95 | QSARToolbox | 0 » -1 |
| 8.36 | OCHEM | 0 » -1 |
| 8.36 | OCHEM | 0 » -1 |
| 8.37 | QSARToolbox | 0 » -1 |
| 8.37 | OCHEM | 0 » -1 |
| 8.37 | OCHEM | 0 » -1 |
| 8.37 | OCHEM | 0 » -1 |
| 8.61 | OCHEM | 0 » -1 |
| 8.61 | Datawarrior | 0 » -1 |
| 8.66 | QSARToolbox | 0 » -1 |
| 8.89 | IUPAC digitized pKa | 0 » -1 |
| 8.89 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 8.89 | OCHEM | 0 » -1 |
| 8.89 | OCHEM | 0 » -1 |
| 8.89 | QSARToolbox | 0 » -1 |