BDBM130 (4R,5S,6S,7R)-1,3-bis[4-amino-4-(4-fluorophenyl)butyl]-4,7-dibenzyl-5,6-dihydroxy-1,3-diazepan-2-one::DMPC Cyclic Urea 110

SMILES NC(CCCN1C(=O)N(CCCC(N)c2ccc(F)cc2)[C@H](Cc2ccccc2)[C@H](O)[C@@H](O)[C@H]1Cc1ccccc1)c1ccc(F)cc1

InChI Key InChIKey=CWRJATMIQRJWLU-UHFFFAOYSA-N

Data  1 KI

  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 = 130   

TargetDimer of Gag-Pol polyprotein [501-599](Human immunodeficiency virus type 1)
Dupont Pharmaceuticals

LigandChemical structure of BindingDB Monomer ID 130BDBM130((4R,5S,6S,7R)-1,3-bis[4-amino-4-(4-fluorophenyl)bu...)
Affinity DataKi:  1.70E+3nM ΔG°:  -8.18kcal/molepH: 5.5 T: 2°CAssay Description:Ki values were determined with recombinant single-chain dimeric HIV protease and a fluorescent substrate. The use of single-chain dimeric protease a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/18/2001
Entry Details Article
PubMed