BDBM7041 (4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis(cyclohexylmethyl)-5,6-dihydroxy-1,3-diazepan-2-one::(4R,5S,6S,7R)-Hexahydro-5,6-dihydroxy-1,3-bis-(phenylmethyl)-4,7-bis(cyclohexylmethyl)-2H-1,3-diazapin-2-one::Substituted Cyclic Urea 29

SMILES O[C@@H]1[C@@H](O)[C@@H](CC2CCCCC2)N(Cc2ccccc2)C(=O)N(Cc2ccccc2)[C@@H]1CC1CCCCC1

InChI Key InChIKey=GFJUQXPENVFSPL-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 7041   

TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Dupont Pharmaceuticals

LigandPNGBDBM7041((4R,5S,6S,7R)-1,3-dibenzyl-4,7-bis(cyclohexylmethy...)
Affinity DataKi:  28nM ΔG°:  -10.7kcal/molepH: 5.5 T: 2°CAssay Description:Inhibition of HIV protease was measured by assay of the cleavage of a fluorescent peptide substrate. The fluorescent product (2-aminobenzoyl-Ala-Thr-...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/9/2006
Entry Details Article
PubMed