Molecule ID: mol24329

SMILES: CCN(C)CCCc1ccc2ccccc2c1

InChI: InChI=1S/C16H21N/c1-3-17(2)12-6-7-14-10-11-15-8-4-5-9-16(15)13-14/h4-5,8-11,13H,3,6-7,12H2,1-2H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization