Molecule ID: mol18840
SMILES: O=[N+]([O-])c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1
InChI: InChI=1S/C12H9ClN2O4S/c13-9-4-6-10(7-5-9)14-20(18,19)12-3-1-2-11(8-12)15(16)17/h1-8,14H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.19 | OCHEM | 0 » -1 |
| 7.19 | OCHEM | 0 » -1 |
| 7.19 | Baltruschat ChEMBL | 0 » -1 |