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Ligand

NameCHEMBL58387
Molecular formulaC31H38N4O
IUPAC name(2,4-dimethylpyridin-3-yl)-[4-methyl-4-[4-(N-phenylanilino)piperidin-1-yl]piperidin-1-yl]methanone
Molecular weight482.672
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.8
Synonyms(2,4-dimethylpyridin-3-yl)-[4-methyl-4-[4-(N-phenylanilino)piperidin-1-yl]piperidin-1-yl]methanone
BDBM50143757
(2,4-Dimethyl-pyridin-3-yl)-(4-diphenylamino-4''-methyl-[1,4'']bipiperidinyl-1''-yl)-methanone
[1,4'-Bipiperidin]-4-amine, 1'-[(2,4-dimethyl-3-pyridinyl)carbonyl]-4'-methyl-N,N-diphenyl-
(2,4-dimethylpyridin-3-yl)(4-(4-(diphenylamino)piperidin-1-yl)-4-methylpiperidin-1-yl)methanone
[ Show all ]
Inchi KeyKFQMAIZBNWWGPO-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H38N4O/c1-24-14-19-32-25(2)29(24)30(36)33-22-17-31(3,18-23-33)34-20-15-28(16-21-34)35(26-10-6-4-7-11-26)27-12-8-5-9-13-27/h4-14,19,28H,15-18,20-23H2,1-3H3
PubChem CID3008927
ChEMBLCHEMBL58387
IUPHARN/A
BindingDB50143757
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
168004C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352
168005C-C chemokine receptor type 5P61814CCR5Macaca fascicularis (Crab-eating macaque)352

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