BDBM50283158 (6S,7S,8aS)-2-[(R)-2-Hydroxy-2-((1S,15S)-15-isopropyl-13,16-dioxo-2,6-dioxa-14,17-diaza-tricyclo[18.2.2.0*7,12*]tetracosa-1(23),7,9,11,20(24),21-hexaen-18-yl)-ethyl]-decahydro-isoquinoline-3-carboxylic acid tert-butylamide::CHEMBL306897

SMILES CC(C)[C@@H]1NC(=O)c2ccccc2OCCCOc2ccc(C[C@H](NC1=O)[C@H](O)CN1CC3CCCCC3C[C@H]1C(=O)NC(C)(C)C)cc2

InChI Key InChIKey=GRKWALBGUZROQR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50283158   

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

Curated by ChEMBL
LigandPNGBDBM50283158((6S,7S,8aS)-2-[(R)-2-Hydroxy-2-((1S,15S)-15-isopro...)
Affinity DataIC50: 8nMAssay Description:In vitro inhibition HIV-1 IIIB protease.More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2010
Entry Details Article