Molecule ID: mol5888

SMILES: C#CC(C)(C)N(C)C(C)(C)C#C

InChI: InChI=1S/C11H17N/c1-8-10(3,4)12(7)11(5,6)9-2/h1-2H,3-7H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization