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Ligand

NameCHEMBL424987
Molecular formulaC29H30N6O2
IUPAC nameN-ethyl-4-[[8-(furan-3-ylmethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]-[3-(2H-tetrazol-5-yl)phenyl]methyl]benzamide
Molecular weight494.599
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.4
SynonymsBDBM50155081
N-Ethyl-4-{(8-furan-3-ylmethyl-8-aza-bicyclo[3.2.1]oct-3-ylidene)-[3-(1H-tetrazol-5-yl)-phenyl]-methyl}-benzamide
Inchi KeyBXXDMDBGBDJJIR-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H30N6O2/c1-2-30-29(36)21-8-6-20(7-9-21)27(22-4-3-5-23(14-22)28-31-33-34-32-28)24-15-25-10-11-26(16-24)35(25)17-19-12-13-37-18-19/h3-9,12-14,18,25-26H,2,10-11,15-17H2,1H3,(H,30,36)(H,31,32,33,34)
PubChem CID44395511
ChEMBLCHEMBL424987
IUPHARN/A
BindingDB50155081
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
35547Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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