Molecule ID: mol37053

SMILES: c1ccc(CC[N+]23CCC(CC2)CC3)nc1

InChI: InChI=1S/C14H21N2/c1-2-8-15-14(3-1)7-12-16-9-4-13(5-10-16)6-11-16/h1-3,8,13H,4-7,9-12H2/q+1

Experimental Macro pKa Values

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Macro pKa value Dataset Assigned charge state transition
3.81 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization