Molecule ID: mol5901

SMILES: CCCCNC(C)C#N

InChI: InChI=1S/C7H14N2/c1-3-4-5-9-7(2)6-8/h7,9H,3-5H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization