Molecule ID: mol24646

SMILES: C1CCCC(N2CCCCNCC2)CCC1

InChI: InChI=1S/C14H28N2/c1-2-4-8-14(9-5-3-1)16-12-7-6-10-15-11-13-16/h14-15H,1-13H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
2.78 AttenGpKa training set 2 » 1
8.77 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization