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SMILES: COc1cccc(CN2C(=O)C[C@@]3(C(=O)N(CC(O)=O)c4ccc(Cl)cc34)C2=O)c1

InChI Key: InChIKey=IJRKCYVJCJRDTH-OAQYLSRUSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 21607   
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
Prostaglandin D2 receptor 2


(Homo sapiens (Human))		BDBM21607
PNG
(2-[(3R)-5-chloro-1'-[(3-methoxyphenyl)methyl]-1,2-...)
Show SMILES COc1cccc(CN2C(=O)C[C@@]3(C(=O)N(CC(O)=O)c4ccc(Cl)cc34)C2=O)c1 |r|
Show InChI InChI=1S/C21H17ClN2O6/c1-30-14-4-2-3-12(7-14)10-24-17(25)9-21(20(24)29)15-8-13(22)5-6-16(15)23(19(21)28)11-18(26)27/h2-8H,9-11H2,1H3,(H,26,27)/t21-/m1/s1
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Article
PubMed
 72n/an/an/an/an/an/an/an/a



Merck Serono



Assay Description
A scintillation proximity assay was used for radioligand competition and saturation binding assays. Nonspecific binding was determined in the presenc...

J Med Chem 51: 2227-2243 (2008)


Article DOI: 10.1021/jm701383e
BindingDB Entry DOI: 10.7270/Q22R3PZS
More data for this
Ligand-Target Pair