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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL126332
Molecular formulaC15H25N3O2S
IUPAC name3-(1-azabicyclo[2.2.2]octan-3-yloxy)-4-hexoxy-1,2,5-thiadiazole
Molecular weight311.444
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.9
SynonymsBDBM50062584
L017456
3-(4-Hexyloxy-[1,2,5]thiadiazol-3-yloxy)-1-aza-bicyclo[2.2.2]octane
Inchi KeyAZVUMUFNNDXLDJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H25N3O2S/c1-2-3-4-5-10-19-14-15(17-21-16-14)20-13-11-18-8-6-12(13)7-9-18/h12-13H,2-11H2,1H3
PubChem CID44214356
ChEMBLCHEMBL126332
IUPHARN/A
BindingDB50062584
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
18523Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
18524Muscarinic acetylcholine receptor M1P11229CHRM1Homo sapiens (Human)460

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