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SMILES: CCc1c(Sc2ccccc2)n(C\C=C\c2cccs2)c(=O)[nH]c1=O

InChI Key: InChIKey=LGBXPEBWNHODMP-UXBLZVDNSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50058327   
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
Reverse transcriptase/RNaseH


(Human immunodeficiency virus 1)		BDBM50058327
PNG
(5-Ethyl-6-phenylsulfanyl-1-((E)-3-thiophen-2-yl-al...)
Show SMILES CCc1c(Sc2ccccc2)n(C\C=C\c2cccs2)c(=O)[nH]c1=O
Show InChI InChI=1S/C19H18N2O2S2/c1-2-16-17(22)20-19(23)21(12-6-10-14-11-7-13-24-14)18(16)25-15-8-4-3-5-9-15/h3-11,13H,2,12H2,1H3,(H,20,22,23)/b10-6+
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Similars
Article
PubMed
n/an/an/an/a 80n/an/an/an/a



Université d'Orléans

Curated by ChEMBL


Assay Description
Inhibitory concentration against HIV-1 reverse transcriptase

J Med Chem 40: 4257-64 (1998)


Article DOI: 10.1021/jm970110p
BindingDB Entry DOI: 10.7270/Q2WS8SC3
More data for this
Ligand-Target Pair