Molecule ID: mol15287
SMILES: O=C1NC(=O)C2(CCOc3ccc(F)cc32)N1
InChI: InChI=1S/C11H9FN2O3/c12-6-1-2-8-7(5-6)11(3-4-17-8)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 8.30 | Datawarrior | 0 » -1 |
| 8.30 | QSARToolbox | 0 » -1 |
| 8.30 | OCHEM | 0 » -1 |