Molecule ID: mol34670

SMILES: CC(=NNC(=S)NN=C(C)c1ccccn1)c1ccccn1

InChI: InChI=1S/C15H16N6S/c1-11(13-7-3-5-9-16-13)18-20-15(22)21-19-12(2)14-8-4-6-10-17-14/h3-10H,1-2H3,(H2,20,21,22)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization