Molecule ID: mol5035
SMILES: Nc1ccc2cnc3ccccc3c2c1
InChI: InChI=1S/C13H10N2/c14-10-6-5-9-8-15-13-4-2-1-3-11(13)12(9)7-10/h1-8H,14H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.84 | IUPAC digitized pKa | 1 » 0 |
| 6.84 | QSARToolbox | 1 » 0 |
| 6.88 | Datawarrior | 1 » 0 |
| 6.88 | OCHEM | 1 » 0 |
| 6.88 | QSARToolbox | 1 » 0 |