Molecule ID: mol15617
SMILES: COc1ccc(S(=O)(=O)CCN2CCOCC2)c(OC)c1OC
InChI: InChI=1S/C15H23NO6S/c1-19-12-4-5-13(15(21-3)14(12)20-2)23(17,18)11-8-16-6-9-22-10-7-16/h4-5H,6-11H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.89 | OCHEM | 1 » 0 |
| 4.89 | Datawarrior | 1 » 0 |