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SMILES: Oc1cc(oc(=O)c1SCc1ccccc1)-c1ccccc1Cl

InChI Key: InChIKey=PNEOHWQJPRRGPT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50287033   
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
Gag-Pol polyprotein [489-587]


(Human immunodeficiency virus type 1)		BDBM50287033
PNG
(3-Benzylsulfanyl-6-(2-chloro-phenyl)-4-hydroxy-pyr...)
Show SMILES Oc1cc(oc(=O)c1SCc1ccccc1)-c1ccccc1Cl
Show InChI InChI=1S/C18H13ClO3S/c19-14-9-5-4-8-13(14)16-10-15(20)17(18(21)22-16)23-11-12-6-2-1-3-7-12/h1-10,20H,11H2
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Similars
Article
n/an/a 2.54E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against HIV-1 protease(PR).

Bioorg Med Chem Lett 6: 1133-1138 (1996)


Article DOI: 10.1016/0960-894X(96)00185-0
BindingDB Entry DOI: 10.7270/Q2GB2418
More data for this
Ligand-Target Pair