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BDBM50197750 (2E)-2-{5-tert-butyl-2-[(4-chlorobenzyl)oxy]benzylidene}hydrazinecarboximidamide::CHEMBL240838

SMILES: [#6]C([#6])([#6])c1ccc(-[#8]-[#6]-c2ccc(Cl)cc2)c(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])c1

InChI Key: InChIKey=RQABRMDJDHEIHT-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50197750   
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))
BDBM50197750
PNG
((2E)-2-{5-tert-butyl-2-[(4-chlorobenzyl)oxy]benzyl...)
Show SMILES [#6]C([#6])([#6])c1ccc(-[#8]-[#6]-c2ccc(Cl)cc2)c(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])c1 |w:18.18|
Show InChI InChI=1S/C19H23ClN4O/c1-19(2,3)15-6-9-17(14(10-15)11-23-24-18(21)22)25-12-13-4-7-16(20)8-5-13/h4-11H,12H2,1-3H3,(H4,21,22,24)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Displacement of [125I]MIP1alpha from human CCR5/CD4 expressed in HEK293 cells


Bioorg Med Chem Lett 17: 231-4 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.052
BindingDB Entry DOI: 10.7270/Q2FQ9W8N
More data for this
Ligand-Target Pair