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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

NameCHEMBL125326
Molecular formulaC18H33N3
IUPAC name(3S,6R)-3-methyl-7-[(4-methylcyclohexyl)methyl]-6-(2-methylpropyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazole
Molecular weight291.483
Hydrogen bond acceptor1
Hydrogen bond donor0
XlogP4.0
SynonymsN/A
Inchi KeyAPOUUTUFHCRHAM-ODZFXCKXSA-N
Inchi IDInChI=1S/C18H33N3/c1-13(2)9-17-12-20-15(4)10-19-18(20)21(17)11-16-7-5-14(3)6-8-16/h13-17H,5-12H2,1-4H3/t14?,15-,16?,17+/m0/s1
PubChem CID44348681
ChEMBLCHEMBL125326
IUPHARN/A
BindingDBN/A
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
11187Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
11188Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380

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