Molecule ID: mol8397

SMILES: CC1N2CCCN1c1ccccc1C2

InChI: InChI=1S/C12H16N2/c1-10-13-7-4-8-14(10)12-6-3-2-5-11(12)9-13/h2-3,5-6,10H,4,7-9H2,1H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.50 IUPAC digitized pKa 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization