pKahub
About
Molecules
Datasets
Molecule ID:
mol37294
SMILES:
NC(=O)NNS
InChI:
InChI=1S/CH5N3OS/c2-1(5)3-4-6/h4,6H,(H3,2,3,5)
Experimental Macro pKa Values
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JSON
SMILES
SDF
Macro pKa value
Dataset
Assigned charge state transition
1.88
QSARToolbox
1 » 0
12.81
QSARToolbox
-1 » -2
13.42
QSARToolbox
-1 » -2
Download Microspecies:
MICRO SMILES
MICRO SDF
Charge States and Microspecies Visualization