Molecule ID: mol26665
SMILES: Cc1nc2nc3ccccc3c(O)c2cc1N
InChI: InChI=1S/C13H11N3O/c1-7-10(14)6-9-12(17)8-4-2-3-5-11(8)16-13(9)15-7/h2-6H,14H2,1H3,(H,15,16,17)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -5.98 | AttenGpKa training set | 3 » 2 |