Molecule ID: mol14507
SMILES: C[n+]1c2ccccc2nc2ccc(O)cc21
InChI: InChI=1S/C13H10N2O/c1-15-12-5-3-2-4-10(12)14-11-7-6-9(16)8-13(11)15/h2-8H,1H3/p+1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.00 | Datawarrior | 1 » 0 |
| 3.00 | OCHEM | 1 » 0 |
| 3.00 | AttenGpKa training set | 1 » 0 |