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SMILES: CCCCCC(=O)c1ccc2Sc3ccccc3N(CCCN(C)C)c2c1

InChI Key: InChIKey=ZFVKFWIIMQSPBV-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50408511   
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
Trypanothione reductase


(Trypanosoma cruzi)		BDBM50408511
PNG
(CHEMBL289609)
Show SMILES CCCCCC(=O)c1ccc2Sc3ccccc3N(CCCN(C)C)c2c1
Show InChI InChI=1S/C23H30N2OS/c1-4-5-6-11-21(26)18-13-14-23-20(17-18)25(16-9-15-24(2)3)19-10-7-8-12-22(19)27-23/h7-8,10,12-14,17H,4-6,9,11,15-16H2,1-3H3
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Similars
Article
PubMed
n/an/a 1.71E+5n/an/an/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibitory activity against recombinant Trypanosoma cruzi (Trypanosoma cruzi) Trypanothione reductase

J Med Chem 41: 148-56 (1998)


Article DOI: 10.1021/jm960814j
BindingDB Entry DOI: 10.7270/Q2ZP457X
More data for this
Ligand-Target Pair