Molecule ID: mol14958
SMILES: COc1ccc(NC(=S)c2cccc(Br)c2)cc1
InChI: InChI=1S/C14H12BrNOS/c1-17-13-7-5-12(6-8-13)16-14(18)10-3-2-4-11(15)9-10/h2-9H,1H3,(H,16,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.99 | Datawarrior | 0 » -1 |
| 10.99 | OCHEM | 0 » -1 |