Molecule ID: mol20986
SMILES: NS(=O)(=O)c1ccc(SCCO)c(F)c1
InChI: InChI=1S/C8H10FNO3S2/c9-7-5-6(15(10,12)13)1-2-8(7)14-4-3-11/h1-2,5,11H,3-4H2,(H2,10,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.76 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 9.76 | Baltruschat ChEMBL | 0 » -1 |