Molecule ID: mol15526
SMILES: Nc1ccc2nc(/C=C/c3ccccc3)ccc2c1
InChI: InChI=1S/C17H14N2/c18-15-8-11-17-14(12-15)7-10-16(19-17)9-6-13-4-2-1-3-5-13/h1-12H,18H2/b9-6+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.50 | Datawarrior | 1 » 0 |
| 5.50 | QSARToolbox | 1 » 0 |