Molecule ID: mol35089

SMILES: CSSc1c(C)c(SSC)n2ccncc12

InChI: InChI=1S/C10H12N2S4/c1-7-9(15-13-2)8-6-11-4-5-12(8)10(7)16-14-3/h4-6H,1-3H3

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization