Molecule ID: mol32617

SMILES: S=C(N=Nc1ccccc1)NNc1ccccc1

InChI: InChI=1S/C13H12N4S/c18-13(16-14-11-7-3-1-4-8-11)17-15-12-9-5-2-6-10-12/h1-10,14H,(H,16,18)

Experimental Macro pKa Values

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

Charge States and Microspecies Visualization