Molecule ID: mol14054

SMILES: NCCCCCCNC(=S)S

InChI: InChI=1S/C7H16N2S2/c8-5-3-1-2-4-6-9-7(10)11/h1-6,8H2,(H2,9,10,11)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization