Molecule ID: mol28056
SMILES: N=C(NCc1ccccc1)N[N+](=O)[O-]
InChI: InChI=1S/C8H10N4O2/c9-8(11-12(13)14)10-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 12.00 | QSARToolbox | 0 » -1 |
| 12.00 | AttenGpKa training set | 0 » -1 |