Molecule ID: mol20958
SMILES: NS(=O)(=O)c1ccc(SCCCCO)cc1
InChI: InChI=1S/C10H15NO3S2/c11-16(13,14)10-5-3-9(4-6-10)15-8-2-1-7-12/h3-6,12H,1-2,7-8H2,(H2,11,13,14)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.17 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 10.17 | Baltruschat ChEMBL | 0 » -1 |