Molecule ID: mol15291
SMILES: Cc1ccc2nc(C)c3c(c2c1)OC(C)C3C
InChI: InChI=1S/C15H17NO/c1-8-5-6-13-12(7-8)15-14(10(3)16-13)9(2)11(4)17-15/h5-7,9,11H,1-4H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.65 | Datawarrior | 1 » 0 |
| 7.65 | QSARToolbox | 1 » 0 |
| 7.65 | OCHEM | 1 » 0 |