Molecule ID: mol36840

SMILES: CCCCCCc1cc[n+](CC(=O)O)cc1

InChI: InChI=1S/C13H19NO2/c1-2-3-4-5-6-12-7-9-14(10-8-12)11-13(15)16/h7-10H,2-6,11H2,1H3/p+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization