Molecule ID: mol31876
SMILES: O=S(=O)(/C=C/c1ccc(O)cc1)Oc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
InChI: InChI=1S/C14H7Cl5O4S/c15-9-10(16)12(18)14(13(19)11(9)17)23-24(21,22)6-5-7-1-3-8(20)4-2-7/h1-6,20H/b6-5+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.64 | QSARToolbox | 0 » -1 |
| 7.64 | OCHEM | 0 » -1 |