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Ligand

NameCHEMBL107092
Molecular formulaC28H35F3N2O
IUPAC name(2,6-dimethylphenyl)-[4-methyl-4-[4-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-yl]piperidin-1-yl]methanone
Molecular weight472.596
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP6.5
Synonyms(2,6-Dimethyl-phenyl)-[4''-methyl-4-(4-trifluoromethyl-benzyl)-[1,4'']bipiperidinyl-1''-yl]-methanone
1,4'-Bipiperidine, 1'-(2,6-dimethylbenzoyl)-4'-methyl-4-[[4-(trifluoromethyl)phenyl]methyl]-
BDBM50115543
(2,6-dimethylphenyl)-[4-methyl-4-[4-[[4-(trifluoromethyl)phenyl]methyl]-1-piperidyl]-1-piperidyl]methanone
(2,6-dimethylphenyl)-[4-methyl-4-[4-[[4-(trifluoromethyl)phenyl]methyl]piperidin-1-yl]piperidin-1-yl]methanone
[ Show all ]
Inchi KeyGZYLUVFSBIJQAU-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H35F3N2O/c1-20-5-4-6-21(2)25(20)26(34)32-17-13-27(3,14-18-32)33-15-11-23(12-16-33)19-22-7-9-24(10-8-22)28(29,30)31/h4-10,23H,11-19H2,1-3H3
PubChem CID511304
ChEMBLCHEMBL107092
IUPHARN/A
BindingDB50115543
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
109613C-C chemokine receptor type 5P51682Ccr5Mus musculus (Mouse)354
109614C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352

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