Brief Information of the Compound and Protein
Compound Name
(R)-1-butyl-3-((R)-cyclohexyl(hydroxy)methyl)-9-(4-phenoxybenzyl)-1,4,9-triazaspiro[5.5]undecane-2,5-dione hydrochloride
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PubChem ID
CID: 23577403
Canonical SMILES
CCCCN1C(=O)[C@@H]([C@H](O)C2CCCCC2)NC(=O)C12CCN(Cc1ccc(Oc3ccccc3)cc1)CC2.Cl
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Compound Formula C32H44ClN3O4
Compound Structure
Protein Name
C-C chemokine receptor type 5
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
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 Cricetulus griseus (Chinese hamster)  2
1
IC50 = 1.1 nM
   TI
   LI
   LO
   TS
2
IC50 = 53 nM
   TI
   LI
   LO
   TS
CL000149 HOS Homo sapiens (Human)  2
1
IC50 = 7.762 nM
   TI
   LI
   LO
   TS
2
IC50 = 7800 nM
   TI
   LI
   LO
   TS