Molecule ID: mol7329
SMILES: Cc1nc(NN)c([N+](=O)[O-])c(NN)n1
InChI: InChI=1S/C5H9N7O2/c1-2-8-4(10-6)3(12(13)14)5(9-2)11-7/h6-7H2,1H3,(H2,8,9,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.10 | OCHEM | 1 » 0 |
| 4.40 | IUPAC digitized pKa | 1 » 0 |
| 4.40 | QSARToolbox | 1 » 0 |