Molecule ID: mol36471
SMILES: C(=N/Nc1ccccn1)\c1ccc2ccccc2n1
InChI: InChI=1S/C15H12N4/c1-2-6-14-12(5-1)8-9-13(18-14)11-17-19-15-7-3-4-10-16-15/h1-11H,(H,16,19)/b17-11+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.96 | QSARToolbox | 2 » 1 |
| 5.48 | QSARToolbox | 1 » 0 |