pKahub
About
Molecules
Datasets
Molecule ID:
mol12503
SMILES:
CN(C)C(C)(C)C=O
InChI:
InChI=1S/C6H13NO/c1-6(2,5-8)7(3)4/h5H,1-4H3
Experimental Macro pKa Values
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TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
8.40
OCHEM
1 » 0
8.40
QSARToolbox
1 » 0
8.40
Datawarrior
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization