Molecule ID: mol23084
SMILES: O=C(O)c1c(-c2ccccc2)ccc2ccccc12
InChI: InChI=1S/C17H12O2/c18-17(19)16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-11H,(H,18,19)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 3.05 | AttenGpKa training set | 0 » -1 |