Molecule ID: mol14957
SMILES: COc1ccc(NC(=S)c2ccc(Cl)cc2)cc1
InChI: InChI=1S/C14H12ClNOS/c1-17-13-8-6-12(7-9-13)16-14(18)10-2-4-11(15)5-3-10/h2-9H,1H3,(H,16,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 11.26 | Datawarrior | 0 » -1 |
| 11.26 | OCHEM | 0 » -1 |