Molecule ID: mol18764
SMILES: CCc1oc2ccccc2c1C(=O)c1cc(C)c(O)c(C)c1
InChI: InChI=1S/C19H18O3/c1-4-15-17(14-7-5-6-8-16(14)22-15)19(21)13-9-11(2)18(20)12(3)10-13/h5-10,20H,4H2,1-3H3
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.50 | OCHEM | 0 » -1 |
| 8.50 | Baltruschat ChEMBL | 0 » -1 |