Molecule ID: mol35255

SMILES: NCCCN1CCSCCOCCOCCSCC1

InChI: InChI=1S/C13H28N2O2S2/c14-2-1-3-15-4-10-18-12-8-16-6-7-17-9-13-19-11-5-15/h1-14H2

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
3.19 QSARToolbox 2 » 1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization