Molecule ID: mol36087

SMILES: Clc1c2ccccc2c(CN2CCOCC2)c2ccccc12

InChI: InChI=1S/C19H18ClNO/c20-19-16-7-3-1-5-14(16)18(13-21-9-11-22-12-10-21)15-6-2-4-8-17(15)19/h1-8H,9-13H2

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization