Molecule ID: mol18265
SMILES: COc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2ccc(C)cc12
InChI: InChI=1S/C22H21N3O3S/c1-14-8-10-19-17(12-14)22(16-6-4-5-7-18(16)23-19)24-20-11-9-15(13-21(20)28-2)25-29(3,26)27/h4-13,25H,1-3H3,(H,23,24)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.45 | OCHEM | 1 » 0 |
| 7.45 | Baltruschat ChEMBL | 1 » 0 |
| 7.45 | Baltruschat ChEMBL | 1 » 0 |