Molecule ID: mol9491

SMILES: Cn1nnc2[nH]c(=S)[nH]c(=O)c21

InChI: InChI=1S/C5H5N5OS/c1-10-2-3(8-9-10)6-5(12)7-4(2)11/h1H3,(H2,6,7,11,12)

Experimental Macro pKa Values

Download: TSV JSON SMILES SDF
Macro pKa value Dataset Assigned charge state transition
6.73 IUPAC digitized pKa 0 » -1
Download Microspecies: MICRO SMILES MICRO SDF

Charge States and Microspecies Visualization