Molecule ID: mol1295
SMILES: COc1ccc(CC(=O)O)cc1OC
InChI: InChI=1S/C10H12O4/c1-13-8-4-3-7(6-10(11)12)5-9(8)14-2/h3-5H,6H2,1-2H3,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.32 | AttenGpKa training set | 0 » -1 |
| 4.33 | QSARToolbox | 0 » -1 |
| 4.33 | QSARToolbox | 0 » -1 |
| 4.33 | QSARToolbox | 0 » -1 |
| 4.33 | OCHEM | 0 » -1 |
| 4.33 | OCHEM | 0 » -1 |
| 4.33 | Hunt | 0 » -1 |
| 4.33 | OCHEM | 0 » -1 |
| 4.33 | OCHEM | 0 » -1 |