Molecule ID: mol21556
SMILES: FC(F)(F)c1ccc(-c2nc(-c3ccccc3)c[nH]2)cc1
InChI: InChI=1S/C16H11F3N2/c17-16(18,19)13-8-6-12(7-9-13)15-20-10-14(21-15)11-4-2-1-3-5-11/h1-10H,(H,20,21)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 5.19 | OCHEM | 1 » 0 |
| 5.19 | Baltruschat ChEMBL | 1 » 0 |