Molecule ID: mol12966

SMILES: NC(=S)C1(N)CCCCC1

InChI: InChI=1S/C7H14N2S/c8-6(10)7(9)4-2-1-3-5-7/h1-5,9H2,(H2,8,10)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization