Molecule ID: mol19725

SMILES: COc1ccc(C(CCC(N)C(F)(F)F)(c2ccccc2)c2ccc(C)cc2)cc1

InChI: InChI=1S/C25H26F3NO/c1-18-8-10-20(11-9-18)24(19-6-4-3-5-7-19,17-16-23(29)25(26,27)28)21-12-14-22(30-2)15-13-21/h3-15,23H,16-17,29H2,1-2H3

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.63 Baltruschat ChEMBL 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization