Molecule ID: mol21047
SMILES: COc1ccc(Cl)cc1S(=O)(=O)NC(=O)Nc1ccccc1
InChI: InChI=1S/C14H13ClN2O4S/c1-21-12-8-7-10(15)9-13(12)22(19,20)17-14(18)16-11-5-3-2-4-6-11/h2-9H,1H3,(H2,16,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.50 | Baltruschat ChEMBL | 0 » -1 |