pKahub
About
Molecules
Datasets
Molecule ID:
mol7563
SMILES:
CCc1nccs1
InChI:
InChI=1S/C5H7NS/c1-2-5-6-3-4-7-5/h3-4H,2H2,1H3
Experimental Macro pKa Values
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SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
3.37
IUPAC digitized pKa
1 » 0
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MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization