pKahub
About
Molecules
Datasets
Molecule ID:
mol33670
SMILES:
SC1=CC=CN=[N+]1
InChI:
InChI=1S/C4H4N2S/c7-4-2-1-3-5-6-4/h1-3,7H/q+1
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
-2.68
OCHEM
2 » 1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization