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Ligand

NameMLS000734999
Molecular formulaC20H24N2OS
IUPAC name[1-[(6-methylpyridin-2-yl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone
Molecular weight340.485
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.5
SynonymsCHEMBL1311474
HMS2599P20
MCULE-7398346395
SMR000317331
{1-[(6-methyl-2-pyridinyl)methyl]-3-piperidinyl}[2-(methylthio)phenyl]methanone
[ Show all ]
Inchi KeyAERBGOBZIJWWRX-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H24N2OS/c1-15-7-5-9-17(21-15)14-22-12-6-8-16(13-22)20(23)18-10-3-4-11-19(18)24-2/h3-5,7,9-11,16H,6,8,12-14H2,1-2H3
PubChem CID16188570
ChEMBLCHEMBL1311474
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: 1
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GLASS IDNameUniProtGeneSpeciesLength
3772Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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