Molecule ID: mol6015

SMILES: CCc1ccc(N(CC[N+]2(C)CCCCC2)C2CCCCC2)cc1

InChI: InChI=1S/C22H37N2/c1-3-20-12-14-22(15-13-20)23(21-10-6-4-7-11-21)16-19-24(2)17-8-5-9-18-24/h12-15,21H,3-11,16-19H2,1-2H3/q+1

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.80 IUPAC digitized pKa 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization