Molecule ID: mol6011
SMILES: Nc1c(Cl)cccc1[N+](=O)[O-]
InChI: InChI=1S/C6H5ClN2O2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3H,8H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -2.43 | AttenGpKa training set | 1 » 0 |
| -2.41 | OCHEM | 1 » 0 |
| -2.41 | OCHEM | 1 » 0 |
| -2.37 | OCHEM | 1 » 0 |
| -2.23 | QSARToolbox | 1 » 0 |