BDBM50287363 (2R,4S,5S)-5-Amino-4-hydroxy-9-(3-hydroxymethyl-phenyl)-2,7,7-trimethyl-nonanoic acid butylamide::CHEMBL43522

SMILES CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)CC(C)(C)CCc1cccc(CO)c1

InChI Key InChIKey=XNEGTXKJUFNNJJ-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
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287363   

TargetRenin(Human)
TBA

Curated by ChEMBL
LigandPNGBDBM50287363((2R,4S,5S)-5-Amino-4-hydroxy-9-(3-hydroxymethyl-ph...)
Affinity DataIC50: 5.80E+4nMpH: 7.2Assay Description:In vitro binding affinity was tested against purified human renin at pH 7.2More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/20/2010
Entry Details Article