Molecule ID: mol19528

SMILES: CN(C)C(=O)N1CC(c2cc(F)ccc2F)=C[C@@]1(CCCNCCF)c1ccccc1

InChI: InChI=1S/C24H28F3N3O/c1-29(2)23(31)30-17-18(21-15-20(26)9-10-22(21)27)16-24(30,11-6-13-28-14-12-25)19-7-4-3-5-8-19/h3-5,7-10,15-16,28H,6,11-14,17H2,1-2H3/t24-/m0/s1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.80 Baltruschat ChEMBL 1 » 0
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Charge States and Microspecies Visualization