Molecule ID: mol20962
SMILES: NS(=O)(=O)c1ccc(SCCCCCO)cc1
InChI: InChI=1S/C11H17NO3S2/c12-17(14,15)11-6-4-10(5-7-11)16-9-3-1-2-8-13/h4-7,13H,1-3,8-9H2,(H2,12,14,15)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 9.25 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 9.25 | Baltruschat ChEMBL | 0 » -1 |