Molecule ID: mol8857
SMILES: COc1cccc(NN)c1
InChI: InChI=1S/C7H10N2O/c1-10-7-4-2-3-6(5-7)9-8/h2-5,9H,8H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.30 | IUPAC digitized pKa | 1 » 0 |
| 5.30 | OCHEM | 1 » 0 |
| 5.30 | AttenGpKa training set | 1 » 0 |
| 5.30 | QSARToolbox | 1 » 0 |
| 5.30 | QSARToolbox | 1 » 0 |