pKahub
About
Molecules
Datasets
Molecule ID:
mol9008
SMILES:
O=C(O)/C=C\I
InChI:
InChI=1S/C3H3IO2/c4-2-1-3(5)6/h1-2H,(H,5,6)/b2-1-
Experimental Macro pKa Values
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TSV
JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
3.42
IUPAC digitized pKa
0 » -1
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization