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SMILES: CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C1(Cc2ccccc2O1)c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=OMQIHQKBNCOMND-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50339968   
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))		BDBM50339968
PNG
(3,5-dichloro-N-(3-(4-(2-(4-(trifluoromethyl)phenyl...)
Show SMILES CC(CCNC(=O)c1c(Cl)cncc1Cl)N1CCC(CC1)C1(Cc2ccccc2O1)c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C30H30Cl2F3N3O2/c1-19(10-13-37-28(39)27-24(31)17-36-18-25(27)32)38-14-11-22(12-15-38)29(16-20-4-2-3-5-26(20)40-29)21-6-8-23(9-7-21)30(33,34)35/h2-9,17-19,22H,10-16H2,1H3,(H,37,39)
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Article
PubMed
n/an/a 40n/an/an/an/an/an/a



Genzyme Corp.

Curated by ChEMBL


Assay Description
Displacement of [128I]-RANTES from CCR5 expressed in HEK293F cells

Bioorg Med Chem Lett 21: 2450-5 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.058
BindingDB Entry DOI: 10.7270/Q2F76CV3
More data for this
Ligand-Target Pair