Molecule ID: mol11191
SMILES: C=CCc1cccc(C(=O)O)c1
InChI: InChI=1S/C10H10O2/c1-2-4-8-5-3-6-9(7-8)10(11)12/h2-3,5-7H,1,4H2,(H,11,12)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.32 | OCHEM | 0 » -1 |
| 4.32 | AttenGpKa training set | 0 » -1 |
| 4.32 | QSARToolbox | 0 » -1 |
| 4.32 | QSARToolbox | 0 » -1 |