BDBM50105398 (S)-2-{[(S)-2-(3,5-Dichloro-benzenesulfonyl)-1,2,3,4-tetrahydro-isoquinoline-3-carbonyl]-amino}-hexanoic acid::CHEMBL91172

SMILES CCCC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cc(Cl)cc(Cl)c1)C(O)=O

InChI Key InChIKey=BNDNILUNXYAYLK-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 = 50105398   

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

Curated by ChEMBL
LigandPNGBDBM50105398((S)-2-{[(S)-2-(3,5-Dichloro-benzenesulfonyl)-1,2,3...)
Affinity DataIC50: 10nMAssay 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