Molecule ID: mol11379
SMILES: CCOc1ccc([Se]CC(=O)O)cc1
InChI: InChI=1S/C10H12O3Se/c1-2-13-8-3-5-9(6-4-8)14-7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.86 | QSARToolbox | 0 » -1 |
| 3.86 | IUPAC digitized pKa | 0 » -1 |