Molecule ID: mol14467

SMILES: Cc1ccc(C(C)C)c(OCCN(C)C)c1

InChI: InChI=1S/C14H23NO/c1-11(2)13-7-6-12(3)10-14(13)16-9-8-15(4)5/h6-7,10-11H,8-9H2,1-5H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
8.66 OCHEM 1 » 0
8.66 QSARToolbox 1 » 0
8.66 Datawarrior 1 » 0
8.66 Organic Oxygen Acids and Nitrogen Bases 1 » 0
8.66 OCHEM 1 » 0
8.66 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization