Molecule ID: mol34686

SMILES: CC(=O)/C(=C(\C)O)C(c1ccccc1)N1CCCCC1

InChI: InChI=1S/C17H23NO2/c1-13(19)16(14(2)20)17(15-9-5-3-6-10-15)18-11-7-4-8-12-18/h3,5-6,9-10,17,19H,4,7-8,11-12H2,1-2H3/b16-13-

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
13.50 QSARToolbox 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization