Molecule ID: mol18832
SMILES: O=[N+]([O-])c1cccc(NS(=O)(=O)c2ccc(F)cc2)c1
InChI: InChI=1S/C12H9FN2O4S/c13-9-4-6-12(7-5-9)20(18,19)14-10-2-1-3-11(8-10)15(16)17/h1-8,14H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.85 | OCHEM | 0 » -1 |
| 7.85 | OCHEM | 0 » -1 |
| 7.85 | Baltruschat ChEMBL | 0 » -1 |