Molecule ID: mol14482
SMILES: O=C(O)C1c2ccccc2-c2ccccc21
InChI: InChI=1S/C14H10O2/c15-14(16)13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8,13H,(H,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 2.01 | OCHEM | 0 » -1 |
| 3.43 | QSARToolbox | 0 » -1 |
| 3.43 | QSARToolbox | 0 » -1 |
| 3.52 | Datawarrior | 0 » -1 |
| 3.61 | QSARToolbox | 0 » -1 |