Molecule ID: mol21321
SMILES: Cc1ccc2c(Nc3ccc(NS(C)(=O)=O)cc3)c3cccc(C)c3nc2c1
InChI: InChI=1S/C22H21N3O2S/c1-14-7-12-18-20(13-14)24-21-15(2)5-4-6-19(21)22(18)23-16-8-10-17(11-9-16)25-28(3,26)27/h4-13,25H,1-3H3,(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.46 | Baltruschat ChEMBL | 1 » 0 |