Molecule ID: mol15703
SMILES: Cc1c([N+](=O)[O-])cc(Cl)c2nnn(O)c12
InChI: InChI=1S/C7H5ClN4O3/c1-3-5(12(14)15)2-4(8)6-7(3)11(13)10-9-6/h2,13H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.17 | Datawarrior | 0 » -1 |
| 3.17 | AttenGpKa training set | 0 » -1 |
| 3.17 | QSARToolbox | 0 » -1 |
| 3.17 | OCHEM | 0 » -1 |