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SMILES: Cc1cc(C)c(c(C)c1)S(=O)(=O)N[C@H](CNC(=O)c1ccncc1)C(O)=O

InChI Key: InChIKey=ICJUHHLRNHLUSZ-OAHLLOKOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50296606   
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
Integrin alpha-V


(Homo sapiens (Human))		BDBM50296606
PNG
((R)-3-(isonicotinamido)-2-(2,4,6-trimethylphenylsu...)
Show SMILES Cc1cc(C)c(c(C)c1)S(=O)(=O)N[C@H](CNC(=O)c1ccncc1)C(O)=O |r|
Show InChI InChI=1S/C18H21N3O5S/c1-11-8-12(2)16(13(3)9-11)27(25,26)21-15(18(23)24)10-20-17(22)14-4-6-19-7-5-14/h4-9,15,21H,10H2,1-3H3,(H,20,22)(H,23,24)/t15-/m1/s1
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n/an/a 301n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of fibrinogen binding to alphavbeta3 integrin

Bioorg Med Chem Lett 19: 4832-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.041
BindingDB Entry DOI: 10.7270/Q2CJ8DJQ
More data for this
Ligand-Target Pair