Molecule ID: mol6016

SMILES: C[N+]1(CCN(c2ccc(F)cc2)C2CCCCC2)CCCCC1

InChI: InChI=1S/C20H32FN2/c1-23(15-6-3-7-16-23)17-14-22(19-8-4-2-5-9-19)20-12-10-18(21)11-13-20/h10-13,19H,2-9,14-17H2,1H3/q+1

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization