Molecule ID: mol21564
SMILES: FC(F)(F)c1ccc(-c2c[nH]c(-c3ccccc3)n2)cc1
InChI: InChI=1S/C16H11F3N2/c17-16(18,19)13-8-6-11(7-9-13)14-10-20-15(21-14)12-4-2-1-3-5-12/h1-10H,(H,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.31 | OCHEM | 1 » 0 |
| 5.31 | Baltruschat ChEMBL | 1 » 0 |