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BDBM50323002 5-(5-(4'-carbamoyl-1,4'-bipiperidine-1'-carbonyl)-2-(4-chlorophenyl)-3-(2,4-dichlorophenyl)-1H-pyrrol-1-yl)-2,2-dimethylpentanoic acid::CHEMBL1210778

SMILES: CC(C)(CCCn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCCCC1)C(N)=O)C(O)=O

InChI Key: InChIKey=RVGKRCXQMMZTLZ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50323002   
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
Cannabinoid receptor 1


(Rattus norvegicus (rat))		BDBM50323002
PNG
(5-(5-(4'-carbamoyl-1,4'-bipiperidine-1'-carbonyl)-...)
Show SMILES CC(C)(CCCn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCCCC1)C(N)=O)C(O)=O
Show InChI InChI=1S/C35H41Cl3N4O4/c1-34(2,33(45)46)13-6-18-42-29(31(43)40-19-14-35(15-20-40,32(39)44)41-16-4-3-5-17-41)22-27(26-12-11-25(37)21-28(26)38)30(42)23-7-9-24(36)10-8-23/h7-12,21-22H,3-6,13-20H2,1-2H3,(H2,39,44)(H,45,46)
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n/an/a 160n/an/an/an/an/an/a



Sanofi-aventis R&D

Curated by ChEMBL


Assay Description
Binding affinity to CB1 receptor in rat brain synaptosomal membranes

Bioorg Med Chem Lett 20: 4573-7 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.017
BindingDB Entry DOI: 10.7270/Q28G8KV6
More data for this
Ligand-Target Pair