Molecule ID: mol12500

SMILES: CCN(CC)C(C)O

InChI: InChI=1S/C6H15NO/c1-4-7(5-2)6(3)8/h6,8H,4-5H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization