Molecule ID: mol15527
SMILES: Nc1cc(/C=C/c2ccccc2)nc2ccccc12
InChI: InChI=1S/C17H14N2/c18-16-12-14(11-10-13-6-2-1-3-7-13)19-17-9-5-4-8-15(16)17/h1-12H,(H2,18,19)/b11-10+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.30 | Datawarrior | 1 » 0 |
| 9.30 | QSARToolbox | 1 » 0 |