Molecule ID: mol13821
SMILES: Cc1cc(-c2ccccn2)nn1C
InChI: InChI=1S/C10H11N3/c1-8-7-10(12-13(8)2)9-5-3-4-6-11-9/h3-7H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.60 | Datawarrior | 2 » 1 |
| 4.52 | QSARToolbox | 1 » 0 |
| 4.52 | Datawarrior | 1 » 0 |
| 4.52 | OCHEM | 1 » 0 |