BDBM50037002 CHEMBL329981::[2-((2S,4S,5S)-5-{(S)-2-[(S)-1-Benzyl-2-(4-methoxymethoxy-piperidin-1-yl)-2-oxo-ethoxy]-hexanoylamino}-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoylamino)-ethyl]-carbamic acid benzyl ester

SMILES CCCC[C@H](O[C@@H](Cc1ccccc1)C(=O)N1CCC(CC1)OCOC)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)C[C@@H](C(C)C)C(=O)NCCNC(=O)OCc1ccccc1

InChI Key InChIKey=XHJSLERNCSBSSN-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50037002   

TargetRenin(Human)
Abbott Laboratories

Curated by ChEMBL
LigandPNGBDBM50037002([2-((2S,4S,5S)-5-{(S)-2-[(S)-1-Benzyl-2-(4-methoxy...)
Affinity DataIC50: 11nMpH: 7.4Assay Description:Tested in vitro for its ability to inhibit the human plasma renin at pH of 7.4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed