Molecule ID: mol5926

SMILES: CCC(C)CC(C)N

InChI: InChI=1S/C7H17N/c1-4-6(2)5-7(3)8/h6-7H,4-5,8H2,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization