Molecule ID: mol13905
SMILES: CN(c1nc([N+](=O)[O-])n[nH]1)[N+](=O)[O-]
InChI: InChI=1S/C3H4N6O4/c1-7(9(12)13)2-4-3(6-5-2)8(10)11/h1H3,(H,4,5,6)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.12 | QSARToolbox | 0 » -1 |
| 3.12 | OCHEM | 0 » -1 |
| 3.12 | Datawarrior | 0 » -1 |