Molecule ID: mol13839
SMILES: O=[N+]([O-])c1n[nH]c(-n2cncn2)n1
InChI: InChI=1S/C4H3N7O2/c12-11(13)4-7-3(8-9-4)10-2-5-1-6-10/h1-2H,(H,7,8,9)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.00 | Datawarrior | 0 » -1 |
| 2.00 | OCHEM | 0 » -1 |
| 2.00 | QSARToolbox | 0 » -1 |