Molecule ID: mol3544
SMILES: Nc1ccc(C=Cc2ccc(N)cc2)cc1
InChI: InChI=1S/C14H14N2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(16)10-6-12/h1-10H,15-16H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.90 | IUPAC digitized pKa | 1 » 0 |
| 3.90 | QSARToolbox | 1 » 0 |
| 4.90 | OCHEM | 1 » 0 |
| 5.20 | QSARToolbox | 1 » 0 |
| 5.20 | IUPAC digitized pKa | 2 » 1 |