BDBM50009256 2-{1-[1-(2-{1-[1-(1-amino-2-methyl-(1S)-butanamide-2-hydroxyethylcarboxamido)-3-carbamoylpropylcarboxamido]-2-carbamoylethylcarboxamido}-3-phenylpropyl)tetrahydro-1H-2-pyrrolylcarboxamido]-2-methylbutylcarboxamido}-3-methylbutanoic acid::CHEMBL77671

SMILES CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O

InChI Key InChIKey=ORXLSWQOYHIVKX-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 = 50009256   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50009256(2-{1-[1-(2-{1-[1-(1-amino-2-methyl-(1S)-butanamide...)
Affinity DataIC50: 3.5nMAssay Description:The compound was tested for its affinity against HIV-1 proteaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/21/2012
Entry Details Article
PubMed