Molecule ID: mol18591
SMILES: COc1cc(Nc2c3ccccc3nc3ccccc23)ccc1NS(C)(=O)=O
InChI: InChI=1S/C21H19N3O3S/c1-27-20-13-14(11-12-19(20)24-28(2,25)26)22-21-15-7-3-5-9-17(15)23-18-10-6-4-8-16(18)21/h3-13,24H,1-2H3,(H,22,23)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.03 | Baltruschat ChEMBL | 1 » 0 |
| 7.03 | Baltruschat ChEMBL | 1 » 0 |