Molecule ID: mol31715
SMILES: C[C@H](C(=O)O)c1ccccc1
InChI: InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.23 | QSARToolbox | 0 » -1 |
| 4.38 | OCHEM | 0 » -1 |
| 4.38 | OCHEM | 0 » -1 |