Molecule ID: mol16164
SMILES: Cc1ccc2nc(C)nc(O)c2c1
InChI: InChI=1S/C10H10N2O/c1-6-3-4-9-8(5-6)10(13)12-7(2)11-9/h3-5H,1-2H3,(H,11,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.50 | Baltruschat ChEMBL | 1 » 0 |
| 10.20 | Baltruschat ChEMBL | 0 » -1 |