Molecule ID: mol14588
SMILES: CCOC(=O)c1cnc2ccccc2c1O
InChI: InChI=1S/C12H11NO3/c1-2-16-12(15)9-7-13-10-6-4-3-5-8(10)11(9)14/h3-7H,2H2,1H3,(H,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.80 | QSARToolbox | 0 » -1 |
| 9.62 | OCHEM | 0 » -1 |
| 9.62 | Datawarrior | 0 » -1 |
| 9.75 | QSARToolbox | 0 » -1 |