Molecule ID: mol15286
SMILES: Cn1c(-c2ccccc2O)nc2ccccc21
InChI: InChI=1S/C14H12N2O/c1-16-12-8-4-3-7-11(12)15-14(16)10-6-2-5-9-13(10)17/h2-9,17H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.76 | Datawarrior | 1 » 0 |
| 5.76 | OCHEM | 1 » 0 |
| 5.76 | QSARToolbox | 1 » 0 |
| 8.92 | Datawarrior | 0 » -1 |
| 8.92 | OCHEM | 0 » -1 |