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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

NameCHEMBL190815
Molecular formulaC21H25NO
IUPAC name2-[3-[(1R,5S)-3-azabicyclo[3.1.0]hexan-3-yl]-1-phenylpropyl]-4-methylphenol
Molecular weight307.437
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.5
SynonymsBDBM50165018
2-((1R,5S)-3-3-Aza-bicyclo[3.1.0]hex-3-yl-1-phenyl-propyl)-4-methyl-phenol
Inchi KeyBZVDQWZORRJGHQ-DFNIBXOVSA-N
Inchi IDInChI=1S/C21H25NO/c1-15-7-8-21(23)20(11-15)19(16-5-3-2-4-6-16)9-10-22-13-17-12-18(17)14-22/h2-8,11,17-19,23H,9-10,12-14H2,1H3/t17-,18+,19?
PubChem CID44400175
ChEMBLCHEMBL190815
IUPHARN/A
BindingDB50165018
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
36807Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
36808Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589

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