Molecule ID: mol16045

SMILES: Cn1ccc(N)n1

InChI: InChI=1S/C4H7N3/c1-7-3-2-4(5)6-7/h2-3H,1H3,(H2,5,6)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.81 OCHEM 1 » 0
3.81 QSARToolbox 1 » 0
3.81 Datawarrior 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization