BDBM9217 3-{[(3S,5R)-5-benzyl-1-[(2S,4R)-4-benzyl-2-hydroxy-4-{[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]carbamoyl}butyl]-2-oxopyrrolidin-3-yl]methyl}-N-[2-(morpholin-4-yl)ethyl]benzamide::Pyrrolidone scaffold 25

SMILES O[C@@H](C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)CN1[C@@H](Cc2ccccc2)C[C@H](Cc2cccc(c2)C(=O)NCCN2CCOCC2)C1=O

InChI Key InChIKey=ZNPUXZVLHWJJDC-BPZROKCWSA-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 = 9217   

TargetDimer of Gag-Pol polyprotein [501-599,Q508K,L534I,L564I,C568A,C596A](Human immunodeficiency virus type 1)
Glaxosmithkline

LigandPNGBDBM9217(3-{[(3S,5R)-5-benzyl-1-[(2S,4R)-4-benzyl-2-hydroxy...)
Affinity DataKi:  0.150nM ΔG°:  -13.4kcal/molepH: 6.4 T: 2°CAssay Description:The Ki values were determined using fluorogenic substrate, 2-(aminobenzoyl)-Thr-Ile-Nle-Phe(p-NO2)-Gln-ArgNH2. A standard curve relating changes in f...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed