Molecule ID: mol13746
SMILES: Cc1nc(-c2ccccc2)[nH]c1C
InChI: InChI=1S/C11H12N2/c1-8-9(2)13-11(12-8)10-6-4-3-5-7-10/h3-7H,1-2H3,(H,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.00 | Datawarrior | 1 » 0 |
| 7.00 | OCHEM | 1 » 0 |
| 7.00 | QSARToolbox | 1 » 0 |