Molecule ID: mol16274
SMILES: Cc1cc(OC(F)(F)F)ccc1-c1c(Oc2ccc(/C=C/C(=O)O)cc2)c2ccccc2oc1=O
InChI: InChI=1S/C26H17F3O6/c1-15-14-18(35-26(27,28)29)11-12-19(15)23-24(20-4-2-3-5-21(20)34-25(23)32)33-17-9-6-16(7-10-17)8-13-22(30)31/h2-14H,1H3,(H,30,31)/b13-8+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.70 | Baltruschat ChEMBL | 0 » -1 |