Molecule ID: mol36779

SMILES: O=C(CCCN1CCC(O)(c2ccc(F)cc2)CC1)c1ccc(F)cc1

InChI: InChI=1S/C21H23F2NO2/c22-18-7-3-16(4-8-18)20(25)2-1-13-24-14-11-21(26,12-15-24)17-5-9-19(23)10-6-17/h3-10,26H,1-2,11-15H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
8.30 QSARToolbox 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization