Molecule ID: mol15702
SMILES: Cc1c(Cl)c([N+](=O)[O-])cc2c1nnn2O
InChI: InChI=1S/C7H5ClN4O3/c1-3-6(8)4(12(14)15)2-5-7(3)9-10-11(5)13/h2,13H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.10 | OCHEM | 0 » -1 |
| 3.10 | QSARToolbox | 0 » -1 |
| 3.10 | Datawarrior | 0 » -1 |
| 3.10 | AttenGpKa training set | 0 » -1 |