Molecule ID: mol6024
SMILES: Nc1cc(Cl)c([N+](=O)[O-])cc1Cl
InChI: InChI=1S/C6H4Cl2N2O2/c7-3-2-6(10(11)12)4(8)1-5(3)9/h1-2H,9H2
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| -1.78 | AttenGpKa training set | 1 » 0 |
| -1.74 | OCHEM | 1 » 0 |
| -1.74 | OCHEM | 1 » 0 |