pKahub
About
Molecules
Datasets
Molecule ID:
mol33668
SMILES:
SC1=CN=CC=[N+]1
InChI:
InChI=1S/C4H4N2S/c7-4-3-5-1-2-6-4/h1-3,7H/q+1
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
-0.73
OCHEM
2 » 1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization