DIMETHYL SULFOXIDE

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Trade Names
Synonyms
Status
Molecule Category Free-form
ATC G04BX13 M02AX03
UNII YOW8V9698H
EPA CompTox DTXSID2021735

Structure

InChI Key IAZDPXIOMUYVGZ-UHFFFAOYSA-N
Smiles C[S+](C)[O-]
InChI
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H6OS
Molecular Weight 78.14
AlogP -0.01
Hydrogen Bond Acceptor 1.0
Polar Surface Area 17.07
Heavy Atoms 4.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Protease Threonine protease Threonine protease PBT clan Threonine protease T1A subfamily
- - - - 4.89
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Opioid receptor
- - - - 4
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cavia porcellus
- - - - 4
Escherichia coli
- - - - 2.8
Homo sapiens
- - - - 4.89-67.7
Mus musculus
- - - - 15
Trypanosoma cruzi
- - - - 0-0

Cross References

Resources Reference
ChEBI 28262
ChEMBL CHEMBL504
DrugBank DB01093
DrugCentral 906
FDA SRS YOW8V9698H
Human Metabolome Database HMDB0002151
KEGG C11143
PDB DMS
PharmGKB PA449342
PubChem 679
SureChEMBL SCHEMBL59
ZINC ZINC000005224188
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