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SMILES: Oc1cc(Cl)cc2c1NC(=O)O[C@@]2(C#CC1CC1)C(F)(F)F

InChI Key: InChIKey=OOVOMPCQLMFEDT-CYBMUJFWSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50097576   
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)		BDBM50097576
PNG
((S)-6-Chloro-4-cyclopropylethynyl-8-hydroxy-4-trif...)
Show SMILES Oc1cc(Cl)cc2c1NC(=O)O[C@@]2(C#CC1CC1)C(F)(F)F
Show InChI InChI=1S/C14H9ClF3NO3/c15-8-5-9-11(10(20)6-8)19-12(21)22-13(9,14(16,17)18)4-3-7-1-2-7/h5-7,20H,1-2H2,(H,19,21)/t13-/m1/s1
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PubMed
n/an/a>1.25E+4n/an/an/an/an/an/a



DuPont Pharmaceuticals Company

Curated by ChEMBL


Assay Description
Inhibitory activity against HIV-1 reverse transcriptase

Bioorg Med Chem Lett 11: 619-22 (2001)


BindingDB Entry DOI: 10.7270/Q2BC403C
More data for this
Ligand-Target Pair