Molecule ID: mol28062
SMILES: N#Cc1ccc(NC(=N)N[N+](=O)[O-])cc1
InChI: InChI=1S/C8H7N5O2/c9-5-6-1-3-7(4-2-6)11-8(10)12-13(14)15/h1-4H,(H3,10,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.60 | AttenGpKa training set | 0 » -1 |
| 8.60 | QSARToolbox | 0 » -1 |