BDBM50105369 (S)-2-{[(S)-1-(3,4-Dimethoxy-benzenesulfonyl)-pyrrolidine-2-carbonyl]-amino}-hexanoic acid::CHEMBL93912

SMILES CCCC[C@H](NC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(OC)c(OC)c1)C(O)=O

InChI Key InChIKey=WLZSVQHSFOCZDE-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50105369   

TargetIntegrin alpha-4/beta-1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50105369((S)-2-{[(S)-1-(3,4-Dimethoxy-benzenesulfonyl)-pyrr...)
Affinity DataIC50: 45nMAssay Description:Antagonistic activity against VLA-4 integrin of human jurkat cells using [125I]VCAM-Ig as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed