Molecule ID: mol20974
SMILES: NS(=O)(=O)c1ccc(SCCCO)cc1
InChI: InChI=1S/C9H13NO3S2/c10-15(12,13)9-4-2-8(3-5-9)14-7-1-6-11/h2-5,11H,1,6-7H2,(H2,10,12,13)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 10.23 | Organic Oxygen Acids and Nitrogen Bases | 0 » -1 |
| 10.23 | Baltruschat ChEMBL | 0 » -1 |