Molecule ID: mol14804
SMILES: O=c1cc(-c2ccccc2)oc2ccc(O)cc12
InChI: InChI=1S/C15H10O3/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-9,16H
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.62 | AttenGpKa training set | 0 » -1 |
| 9.09 | Datawarrior | 0 » -1 |
| 9.09 | QSARToolbox | 0 » -1 |
| 9.09 | QSARToolbox | 0 » -1 |
| 9.09 | OCHEM | 0 » -1 |