Molecule ID: mol23764

SMILES: c1ccc(N2CCCCC2)cc1

InChI: InChI=1S/C11H15N/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-8H,2,5-6,9-10H2

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
4.97 QSARToolbox 1 » 0
5.20 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization