Molecule ID: mol18859
SMILES: Cc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1
InChI: InChI=1S/C13H12N2O4S/c1-10-2-4-11(5-3-10)14-20(18,19)13-8-6-12(7-9-13)15(16)17/h2-9,14H,1H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 6.78 | OCHEM | 0 » -1 |
| 6.78 | OCHEM | 0 » -1 |
| 6.78 | Baltruschat ChEMBL | 0 » -1 |