Molecule ID: mol14944
SMILES: S=C(Nc1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1
InChI: InChI=1S/C13H8Cl3NS/c14-9-3-1-8(2-4-9)13(18)17-10-5-6-11(15)12(16)7-10/h1-7H,(H,17,18)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.51 | Datawarrior | 0 » -1 |
| 9.51 | OCHEM | 0 » -1 |