BDBM50003172 (diastereomer-1) {1-[6-Cyclohexylmethyl-10-(2,2-dimethyl-propyl)-7-hydroxy-4,8,14-trioxo-1,9-dioxa-5-aza-cyclotetradec-3-ylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester::(diastereomer-2) {1-[6-Cyclohexylmethyl-10-(2,2-dimethyl-propyl)-7-hydroxy-4,8,14-trioxo-1,9-dioxa-5-aza-cyclotetradec-3-ylcarbamoyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester::CHEMBL333234

SMILES CC(C)(C)CC1CCCC(=O)OC[C@H](NC(=O)C(Cc2ccccc2)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)C(=O)O1

InChI Key InChIKey=QHJYMHIZURGIPU-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50003172   

TargetRenin(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50003172(CHEMBL333234 | (diastereomer-2) {1-[6-Cyclohexylme...)
Affinity DataIC50: 1.20E+3nMpH: 7.4Assay Description:Inhibitory activity against human renin inhibition (at pH 7.4)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/23/2012
Entry Details Article
PubMed
TargetRenin(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50003172(CHEMBL333234 | (diastereomer-2) {1-[6-Cyclohexylme...)
Affinity DataIC50: 1.20E+3nMpH: 7.4Assay Description:Inhibitory activity against human renin inhibition (at pH 7.4)More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/23/2012
Entry Details Article
PubMed