Molecule ID: mol33218

SMILES: CCCCCCN=C(N)NC(=N)N

InChI: InChI=1S/C8H19N5/c1-2-3-4-5-6-12-8(11)13-7(9)10/h2-6H2,1H3,(H6,9,10,11,12,13)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.30 OCHEM 2 » 1
3.30 OCHEM 2 » 1
11.44 OCHEM 0 » -1
11.44 OCHEM 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization