Molecule ID: mol19206
SMILES: O=C1C(NS(=O)(=O)c2ccccc2)=C(c2ccc(Cl)cc2)C(=O)c2ccccc21
InChI: InChI=1S/C22H14ClNO4S/c23-15-12-10-14(11-13-15)19-20(24-29(27,28)16-6-2-1-3-7-16)22(26)18-9-5-4-8-17(18)21(19)25/h1-13,24H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.00 | OCHEM | 0 » -1 |
| 5.00 | Baltruschat ChEMBL | 0 » -1 |