Molecule ID: mol11233
SMILES: CCOc1ccc(C)c(C(=O)O)c1
InChI: InChI=1S/C10H12O3/c1-3-13-8-5-4-7(2)9(6-8)10(11)12/h4-6H,3H2,1-2H3,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.86 | QSARToolbox | 0 » -1 |
| 3.86 | QSARToolbox | 0 » -1 |
| 3.86 | OCHEM | 0 » -1 |
| 3.86 | Datawarrior | 0 » -1 |
| 3.86 | OCHEM | 0 » -1 |