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SMILES: Cc1nnc(C)n1C1CCN(CC[C@H](NC(=O)C2CCC(F)(F)CC2)c2cccc(F)c2)CC1

InChI Key: InChIKey=OJZMUURUHJEXLT-QHCPKHFHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50312844   
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
C-C chemokine receptor type 5


(Homo sapiens (Human))		BDBM50312844
PNG
((S)-N-(3-(4-(3,5-dimethyl-4H-1,2,4-triazol-4-yl)pi...)
Show SMILES Cc1nnc(C)n1C1CCN(CC[C@H](NC(=O)C2CCC(F)(F)CC2)c2cccc(F)c2)CC1 |r|
Show InChI InChI=1S/C25H34F3N5O/c1-17-30-31-18(2)33(17)22-8-13-32(14-9-22)15-10-23(20-4-3-5-21(26)16-20)29-24(34)19-6-11-25(27,28)12-7-19/h3-5,16,19,22-23H,6-15H2,1-2H3,(H,29,34)/t23-/m0/s1
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Article
PubMed
n/an/a 38n/an/an/an/an/an/a



Roche Palo Alto

Curated by ChEMBL


Assay Description
Displacement of [128I]RANTES from human CCR5 receptor coexpressed with Galphai6 in CHO cells after 2 hrs by scintillation counting

Bioorg Med Chem Lett 20: 1674-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.080
BindingDB Entry DOI: 10.7270/Q23B6131
More data for this
Ligand-Target Pair