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Ligand

NameCHEMBL105659
Molecular formulaC34H40N4O2
IUPAC namebenzyl N-[1-[4-(benzimidazol-1-yl)-3-methyl-3-phenylbutyl]piperidin-4-yl]-N-prop-2-enylcarbamate
Molecular weight536.72
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP6.7
SynonymsAllyl-[1-(4-benzoimidazol-1-yl-3-methyl-3-phenyl-butyl)-piperidin-4-yl]-carbamic acid benzyl ester
benzyl N-allyl-N-[1-[4-(benzimidazol-1-yl)-3-methyl-3-phenyl-butyl]-4-piperidyl]carbamate
Allyl-[1-(4-benzoimidazol-1-yl-3-methyl-3-phenyl-butyl)-piperidin-4-yl]-carbamic acid, benzyl ester
benzyl N-[1-[4-(benzimidazol-1-yl)-3-methyl-3-phenylbutyl]piperidin-4-yl]-N-prop-2-enylcarbamate
N-Allyl-N-[1-[3-phenyl-3-methyl-4-[1H-benzimidazole-1-yl]butyl]-4-piperidinyl]carbamic acid benzyl ester
[ Show all ]
Inchi KeyBZHHPFLVFONUOE-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H40N4O2/c1-3-21-38(33(39)40-25-28-12-6-4-7-13-28)30-18-22-36(23-19-30)24-20-34(2,29-14-8-5-9-15-29)26-37-27-35-31-16-10-11-17-32(31)37/h3-17,27,30H,1,18-26H2,2H3
PubChem CID483343
ChEMBLCHEMBL105659
IUPHARN/A
BindingDB50106948
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
36444C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355
36443C-C chemokine receptor type 2P41597CCR2Homo sapiens (Human)374
36446C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355
36448C-C chemokine receptor type 4P51679CCR4Homo sapiens (Human)360
36445C-C chemokine receptor type 5P51681CCR5Homo sapiens (Human)352
36447C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352

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