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BDBM50389585 CHEMBL2064263

SMILES: CCCCCCCC\C=C\c1c(C)cc2CCC[n+]2c1C

InChI Key: InChIKey=DXDFWADNZLVOHG-SDNWHVSQSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50389585   
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))
BDBM50389585
PNG
(CHEMBL2064263)
Show SMILES CCCCCCCC\C=C\c1c(C)cc2CCC[n+]2c1C
Show InChI InChI=1S/C20H32N/c1-4-5-6-7-8-9-10-11-14-20-17(2)16-19-13-12-15-21(19)18(20)3/h11,14,16H,4-10,12-13,15H2,1-3H3/q+1/b14-11+
PDB

KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.37E+4n/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Antagonist activity at CCR5 receptor in human MOLT4 cells assessed as inhibition of chemokine-induced calcium mobilization using Fluo-4-AM dye based ...


Eur J Med Chem 55: 395-408 (2012)


Article DOI: 10.1016/j.ejmech.2012.07.049
BindingDB Entry DOI: 10.7270/Q2Q2419S
More data for this
Ligand-Target Pair