Molecule ID: mol12880

SMILES: CCCCSCCN(CC)CC

InChI: InChI=1S/C10H23NS/c1-4-7-9-12-10-8-11(5-2)6-3/h4-10H2,1-3H3

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
5.57 QSARToolbox 1 » 0
8.43 Datawarrior 1 » 0
8.43 OCHEM 1 » 0
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization