Molecule ID: mol20967
SMILES: NS(=O)(=O)c1ccc(CCCO)cc1
InChI: InChI=1S/C9H13NO3S/c10-14(12,13)9-5-3-8(4-6-9)2-1-7-11/h3-6,11H,1-2,7H2,(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 |