Molecule ID: mol5887

SMILES: C#CC(C)(C)NC(C)(C)C#C

InChI: InChI=1S/C10H15N/c1-7-9(3,4)11-10(5,6)8-2/h1-2,11H,3-6H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization