Molecule ID: mol14916
SMILES: Nc1ccc(/C=N/NC(=O)c2ccncc2)cc1
InChI: InChI=1S/C13H12N4O/c14-12-3-1-10(2-4-12)9-16-17-13(18)11-5-7-15-8-6-11/h1-9H,14H2,(H,17,18)/b16-9+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.20 | Datawarrior | 1 » 0 |
| 3.20 | QSARToolbox | 1 » 0 |