Molecule ID: mol17935
SMILES: Cc1cc2c(Cc3ccc(/C=C/C(=O)O)cc3)c(-c3ccc(OC(F)(F)F)cc3)c(=O)oc2cc1O
InChI: InChI=1S/C27H19F3O6/c1-15-12-20-21(13-17-4-2-16(3-5-17)6-11-24(32)33)25(26(34)35-23(20)14-22(15)31)18-7-9-19(10-8-18)36-27(28,29)30/h2-12,14,31H,13H2,1H3,(H,32,33)/b11-6+
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.60 | Baltruschat ChEMBL | -1 » -2 |