Molecule ID: mol16024

SMILES: Cc1nccn1C

InChI: InChI=1S/C5H8N2/c1-5-6-3-4-7(5)2/h3-4H,1-2H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
7.64 QSARToolbox 1 » 0
7.64 OCHEM 1 » 0
7.64 Datawarrior 1 » 0
8.21 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization