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Ligand

NameCHEMBL456053
Molecular formulaC26H25ClN2O2S
IUPAC name2-(1-benzothiophen-3-yl)-5-[(4-chlorophenyl)methyl]-1-(1,4-dioxaspiro[4.5]decan-8-yl)imidazole
Molecular weight465.008
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP5.9
SynonymsBDBM50266204
2-(benzo[b]thiophen-3-yl)-5-(4-chlorobenzyl)-1-(1,4-dioxaspiro[4.5]decan-8-yl)-1H-imidazole
Inchi KeyBPTRIBNSVMBJGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H25ClN2O2S/c27-19-7-5-18(6-8-19)15-21-16-28-25(23-17-32-24-4-2-1-3-22(23)24)29(21)20-9-11-26(12-10-20)30-13-14-31-26/h1-8,16-17,20H,9-15H2
PubChem CID44581615
ChEMBLCHEMBL456053
IUPHARN/A
BindingDB50266204
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
29898C5a anaphylatoxin chemotactic receptor 1P21730C5AR1Homo sapiens (Human)350

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