pKahub
About
Molecules
Datasets
Molecule ID:
mol12366
SMILES:
Cc1cn(C)nc1C
InChI:
InChI=1S/C6H10N2/c1-5-4-8(3)7-6(5)2/h4H,1-3H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
3.56
OCHEM
1 » 0
3.56
QSARToolbox
1 » 0
3.56
Datawarrior
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization