Molecule ID: mol28571
SMILES: O=C(NC1CCCCC1)NS(=O)(=O)c1ccccc1
InChI: InChI=1S/C13H18N2O3S/c16-13(14-11-7-3-1-4-8-11)15-19(17,18)12-9-5-2-6-10-12/h2,5-6,9-11H,1,3-4,7-8H2,(H2,14,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.06 | AttenGpKa training set | 0 » -1 |