Molecule ID: mol19656
SMILES: CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3ccccc32)c1
InChI: InChI=1S/C21H19ClN4O3S2/c1-14(27)23-12-15-5-4-6-16(11-15)13-26-18-8-3-2-7-17(18)21(24-26)25-31(28,29)20-10-9-19(22)30-20/h2-11H,12-13H2,1H3,(H,23,27)(H,24,25)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.93 | Baltruschat ChEMBL | 0 » -1 |