Molecule ID: mol19527
SMILES: CN(C)C(=O)N1CC(c2cc(F)ccc2F)=C[C@@]1(CCCNCC(F)F)c1ccccc1
InChI: InChI=1S/C24H27F4N3O/c1-30(2)23(32)31-16-17(20-13-19(25)9-10-21(20)26)14-24(31,18-7-4-3-5-8-18)11-6-12-29-15-22(27)28/h3-5,7-10,13-14,22,29H,6,11-12,15-16H2,1-2H3/t24-/m0/s1
| Macro pKa value | Dataset | Assigned charge state transition |
|---|---|---|
| 7.00 | Baltruschat ChEMBL | 1 » 0 |