Molecule ID: mol8868
SMILES: Cc1ccc(NN)cc1
InChI: InChI=1S/C7H10N2/c1-6-2-4-7(9-8)5-3-6/h2-5,9H,8H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.32 | IUPAC digitized pKa | 1 » 0 |
| 5.32 | QSARToolbox | 1 » 0 |
| 5.41 | OCHEM | 1 » 0 |
| 5.41 | AttenGpKa training set | 1 » 0 |
| 5.49 | QSARToolbox | 1 » 0 |
| 5.49 | IUPAC digitized pKa | 1 » 0 |