Molecule ID: mol15169
SMILES: O=NNc1nc([N+](=O)[O-])nn1-c1ccccc1
InChI: InChI=1S/C8H6N6O3/c15-12-10-7-9-8(14(16)17)11-13(7)6-4-2-1-3-5-6/h1-5H,(H,9,10,11,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.33 | OCHEM | 0 » -1 |
| 3.33 | QSARToolbox | 0 » -1 |
| 3.33 | Datawarrior | 0 » -1 |