Molecule ID: mol10879
SMILES: COc1cccc(C(=O)O)c1C
InChI: InChI=1S/C9H10O3/c1-6-7(9(10)11)4-3-5-8(6)12-2/h3-5H,1-2H3,(H,10,11)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.72 | Datawarrior | 0 » -1 |
| 3.72 | OCHEM | 0 » -1 |
| 3.72 | OCHEM | 0 » -1 |
| 3.72 | QSARToolbox | 0 » -1 |
| 3.72 | QSARToolbox | 0 » -1 |