Molecule ID: mol1539

SMILES: CNC(C)(C)Cc1ccccc1

InChI: InChI=1S/C11H17N/c1-11(2,12-3)9-10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
10.37 OCHEM 1 » 0
10.37 OCHEM 1 » 0
10.37 OCHEM 1 » 0
10.37 Hunt 1 » 0
10.37 OCHEM 1 » 0
10.37 AvLiLuMoVe 1 » 0
10.38 IUPAC digitized pKa 1 » 0
10.38 AttenGpKa training set 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization