Brief Information of the Compound and Protein
Compound Name
(S)-N-((1H-benzo[d]imidazol-2-yl)methyl)-N-(4-aminobutyl)-5,6,7,8-tetrahydroquinolin-8-amine
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PubChem ID
CID: 11256587
SID: 16341997
Canonical SMILES
NCCCCN(Cc1nc2ccccc2[nH]1)[C@H]1CCCc2cccnc12
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Compound Formula C21H27N5
Compound Structure
Protein Name
C-X-C chemokine receptor type 4
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Chemokine receptor
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CXC chemokine receptor
Uniprot ID
P61073
Gene Name
CXCR4
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000108 CCRF-CEM Homo sapiens (Human)  3
1
IC50 = 5 nM
   TI
   LI
   LO
   TS
2
IC50 = 5.18 nM
   TI
   LI
   LO
   TS
3
IC50 = 13 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 30 nM