Molecule ID: mol21351
SMILES: Cc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c(C)cccc12
InChI: InChI=1S/C22H21N3O2S/c1-14-7-6-9-18-21(14)24-20-10-5-4-8-17(20)22(18)23-19-12-11-16(13-15(19)2)25-28(3,26)27/h4-13,25H,1-3H3,(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.39 | Baltruschat ChEMBL | 1 » 0 |