pKahub
About
Molecules
Datasets
Molecule ID:
mol6750
SMILES:
Cc1coc(C)n1
InChI:
InChI=1S/C5H7NO/c1-4-3-7-5(2)6-4/h3H,1-2H3
Experimental Macro pKa Values
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TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
2.86
IUPAC digitized pKa
1 » 0
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization