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SMILES: CCOC(=O)\C=C\C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1

InChI Key: InChIKey=BABVEBNJYXWYQX-KQDNUWKFSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50314129   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Cysteine protease


(Trypanosoma brucei rhodesiense)		BDBM50314129
PNG
((S,E)-3-((S)-1-Benzyloxycarbonyl-2-phenylethylcarb...)
Show SMILES CCOC(=O)\C=C\C(=O)N[C@@H](Cc1ccccc1)C(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C22H23NO5/c1-2-27-21(25)14-13-20(24)23-19(15-17-9-5-3-6-10-17)22(26)28-16-18-11-7-4-8-12-18/h3-14,19H,2,15-16H2,1H3,(H,23,24)/b14-13+/t19-/m0/s1
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Similars
Article
PubMed
 7.60E+3n/an/an/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


Assay Description
Inhibition of Trypanosoma brucei rhodesiense recombinant rhodesain by standard fluorescence assay

J Med Chem 53: 1951-63 (2010)


Article DOI: 10.1021/jm900946n
BindingDB Entry DOI: 10.7270/Q2V9887Z
More data for this
Ligand-Target Pair