Molecule ID: mol19216
SMILES: Cc1cc(C)cc(NC2=C(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)C(=O)c3ccccc3C2=O)c1
InChI: InChI=1S/C24H19N3O6S/c1-14-10-15(2)12-16(11-14)25-21-22(24(29)20-9-4-3-8-19(20)23(21)28)26-34(32,33)18-7-5-6-17(13-18)27(30)31/h3-13,25-26H,1-2H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.60 | OCHEM | 0 » -1 |
| 8.60 | Baltruschat ChEMBL | 0 » -1 |