Molecule ID: mol6283
SMILES: Cc1cc(N)cc2ccccc12
InChI: InChI=1S/C11H11N/c1-8-6-10(12)7-9-4-2-3-5-11(8)9/h2-7H,12H2,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.31 | QSARToolbox | 1 » 0 |
| 4.31 | QSARToolbox | 1 » 0 |
| 4.31 | IUPAC digitized pKa | 1 » 0 |
| 4.31 | OCHEM | 1 » 0 |
| 4.31 | AttenGpKa training set | 1 » 0 |