BDBM50073360 CHEMBL333312::N-[(S)-3-(3-Benzyl-1-phenethyl-ureido)-2-hydroxy-propyl]-N-cyclopentylmethyl-4-methoxy-benzenesulfonamide

SMILES COc1ccc(cc1)S(=O)(=O)N(C[C@@H](O)CN(CCc1ccccc1)C(=O)NCc1ccccc1)CC1CCCC1

InChI Key InChIKey=VECYTROZXMZSFL-UHFFFAOYSA-N

Data  1 KI

  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 = 50073360   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Vertex Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50073360(N-[(S)-3-(3-Benzyl-1-phenethyl-ureido)-2-hydroxy-p...)
Affinity DataKi:  22nMAssay Description:Binding affinity against HIV-1 protease was determinedMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed