Molecule ID: mol35960
SMILES: O=C(O)C(=C1CCCCC1)C(C(=O)O)=C(c1ccccc1)c1ccccc1
InChI: InChI=1S/C23H22O4/c24-22(25)20(18-14-8-3-9-15-18)21(23(26)27)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2,(H,24,25)(H,26,27)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 4.81 | QSARToolbox | -1 » -2 |