Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(2R,3R)-2-[(3S,4S)-3-[[4-[5-[[3-(aminomethyl)phenyl]methyl]-2-ethylpyrazol-3-yl]piperidin-1-yl]methyl]-4-(3-fluorophenyl)pyrrolidin-1-yl]-3-methylpentanoic acid
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 PubChem ID
CID: 516241
Canonical SMILES
CC[C@@H](C)[C@@H](N1C[C@H](CN2CCC(CC2)c2cc(Cc3cccc(CN)c3)nn2CC)[C@H](C1)c1cccc(F)c1)C(O)=O
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Compound Formula C35H48FN5O2
Compound Structure
Protein Name
 Protein Info 
C-C chemokine receptor type 5
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
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Chemokine receptor
>
CC chemokine receptor
Uniprot ID
P51681
Gene Name
CCR5
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
IC50 = 2.7 nM
   TI
   LI
   LO
   TS