BDBM50314132 (2S,5S,8S,11S,E)-1-Benzyl 16-ethyl 11-(3-amino-3-oxopropyl)-8-cyclohexyl-5-isopropyl-2-methyl-4,7,10-trioxo-3,6,9,12-tetraazahexadec-14-ene-1,16-dioate::CHEMBL1090646

SMILES CCOC(=O)\C=C\CN[C@@H](CCC(N)=O)C(=O)N[C@@H](C1CCCCC1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)OCc1ccccc1

InChI Key InChIKey=IIFRDHOMHUOVSD-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 = 50314132   

TargetCysteine protease(Trypanosoma brucei rhodesiense)
University of W£Rzburg

Curated by ChEMBL
LigandPNGBDBM50314132((2S,5S,8S,11S,E)-1-Benzyl 16-ethyl 11-(3-amino-3-o...)
Affinity DataKi:  5.80E+3nMAssay Description:Inhibition of Trypanosoma brucei rhodesiense recombinant rhodesain by standard fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/18/2010
Entry Details Article
PubMed