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Ligand

NameCHEMBL106209
Molecular formulaC27H33BrN2O2
IUPAC name(4-bromophenyl)-[1-[1-(2,6-dimethylbenzoyl)-4-methylpiperidin-4-yl]piperidin-4-yl]methanone
Molecular weight497.477
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.4
Synonyms(4-bromophenyl)-[1-[1-(2,6-dimethylbenzoyl)-4-methylpiperidin-4-yl]piperidin-4-yl]methanone
[4-(4-Bromo-benzoyl)-4''-methyl-[1,4'']bipiperidinyl-1''-yl]-(2,6-dimethyl-phenyl)-methanone
AC1L9X07
(4-Bromo-phenyl)-[1''-(2,6-dimethyl-benzoyl)-4''-methyl-[1,4'']bipiperidinyl-4-yl]-methanone
4-(4-Bromobenzoyl)-4'-methyl-1'-(2,6-dimethylbenzoyl)-1,4'-bi(piperidine)
[ Show all ]
Inchi KeyFMNMLKWJLFYSMF-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H33BrN2O2/c1-19-5-4-6-20(2)24(19)26(32)29-17-13-27(3,14-18-29)30-15-11-22(12-16-30)25(31)21-7-9-23(28)10-8-21/h4-10,22H,11-18H2,1-3H3
PubChem CID457671
ChEMBLCHEMBL106209
IUPHARN/A
BindingDB50104939
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
82067C-C chemokine receptor type 5P51682Ccr5Mus musculus (Mouse)354
82068C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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