Molecule ID: mol19654
SMILES: CC(=O)NCc1cccc(Cn2nc(NS(=O)(=O)c3ccc(Cl)s3)c3c(F)cccc32)c1
InChI: InChI=1S/C21H18ClFN4O3S2/c1-13(28)24-11-14-4-2-5-15(10-14)12-27-17-7-3-6-16(23)20(17)21(25-27)26-32(29,30)19-9-8-18(22)31-19/h2-10H,11-12H2,1H3,(H,24,28)(H,25,26)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.62 | Baltruschat ChEMBL | 0 » -1 |