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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50126299   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Prothrombin


(Homo sapiens (Human))		BDBM50126299
PNG
(CHEMBL29592 | N-Benzyl-2-{6-chloro-3-[2,2-difluoro...)
Show SMILES [O-][n+]1ccccc1C(F)(F)CNc1ncc(Cl)n(CC(=O)NCc2ccccc2)c1=O
Show InChI InChI=1S/C20H18ClF2N5O3/c21-16-11-25-18(26-13-20(22,23)15-8-4-5-9-28(15)31)19(30)27(16)12-17(29)24-10-14-6-2-1-3-7-14/h1-9,11H,10,12-13H2,(H,24,29)(H,25,26)
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PubMed
 7n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against human thrombin

Bioorg Med Chem Lett 13: 1353-7 (2003)


BindingDB Entry DOI: 10.7270/Q2833RC9
More data for this
Ligand-Target Pair