pKahub
About
Molecules
Datasets
Molecule ID:
mol12363
SMILES:
Cc1cnn(C)c1C
InChI:
InChI=1S/C6H10N2/c1-5-4-7-8(3)6(5)2/h4H,1-3H3
Experimental Macro pKa Values
Download:
TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
3.58
OCHEM
1 » 0
3.58
QSARToolbox
1 » 0
3.58
Datawarrior
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization