BDBM9861 (2S)-2-[(2-ethylbutyl)(4-methylbenzene)sulfonamido]-6-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}hexanoic acid::Lysine derivative 17

SMILES CCC(CC)CN([C@@H](CCCCNC(=O)OCC1c2ccccc2-c2ccccc12)C(O)=O)S(=O)(=O)c1ccc(C)cc1

InChI Key InChIKey=BKZLAIKLTFTJTM-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 = 9861   

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

LigandPNGBDBM9861((2S)-2-[(2-ethylbutyl)(4-methylbenzene)sulfonamido...)
Affinity DataKi:  15.2nM ΔG°:  -10.8kcal/molepH: 4.7 T: 2°CAssay Description:HIV-1 protease activity was measured by a continuous fluorometric assay using the internally quenched fluorogenic substrate DABCYL-Ser-Gln-Asn-Tyr-Pr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/12/2006
Entry Details Article
PubMed