BDBM50108842 CHEMBL161116::Morpholine-4-carboxylic acid [1-(1-benzyl-3-tert-butylsulfanyl-2-oxo-propylcarbamoyl)-3-methyl-butyl]-amide::N-((S)-1-((S)-4-(tert-butylthio)-3-oxo-1-phenylbutan-2-ylamino)-4-methyl-1-oxopentan-2-yl)morpholine-4-carboxamide

SMILES CC(C)C[C@H](NC(=O)N1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)CSC(C)(C)C

InChI Key InChIKey=RYSAYSVPZRGKCW-UHFFFAOYSA-N

Data  2 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50108842   

TargetCruzipain(Trypanosoma cruzi)
University of California

Curated by ChEMBL
LigandPNGBDBM50108842(N-((S)-1-((S)-4-(tert-butylthio)-3-oxo-1-phenylbut...)
Affinity DataKi:  59.7nMAssay Description:Inhibitory activity against cruzain, the major cysteine protease found in Trypanosoma cruziMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCruzipain(Trypanosoma cruzi)
University of California

Curated by ChEMBL
LigandPNGBDBM50108842(N-((S)-1-((S)-4-(tert-butylthio)-3-oxo-1-phenylbut...)
Affinity DataKi:  59.7nMAssay Description:Inhibition of Trypanosoma cruzi cruzainMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/15/2012
Entry Details Article
PubMed