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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

NameCHEMBL2321893
Molecular formulaC17H20ClNO4
IUPAC name[(1S,3S,5S,6R)-6-acetyloxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 2-chlorobenzoate
Molecular weight337.8
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.2
SynonymsBDBM50427128
Inchi KeyGMQDRAINJQKNMS-GVAFMPQTSA-N
Inchi IDInChI=1S/C17H20ClNO4/c1-10(20)22-16-8-11-7-12(9-15(16)19(11)2)23-17(21)13-5-3-4-6-14(13)18/h3-6,11-12,15-16H,7-9H2,1-2H3/t11-,12-,15-,16+/m0/s1
PubChem CID71718668
ChEMBLCHEMBL2321893
IUPHARN/A
BindingDB50427128
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
100116Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
100115Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589

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