Molecule ID: mol24551

SMILES: CCCN1[C@H](C)CCC[C@@H]1C

InChI: InChI=1S/C10H21N/c1-4-8-11-9(2)6-5-7-10(11)3/h9-10H,4-8H2,1-3H3/t9-,10+

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization