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Ligand

NameCHEMBL3326676
Molecular formulaC21H25FN4O5S2
IUPAC nameS-cyclobutyl 4-[5-fluoro-6-(2-methyl-6-methylsulfonylpyridin-3-yl)oxypyrimidin-4-yl]oxypiperidine-1-carbothioate
Molecular weight496.572
Hydrogen bond acceptor10
Hydrogen bond donor0
XlogP3.3
SynonymsBDBM50056013
Inchi KeyITAGQYIEAGLAHJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25FN4O5S2/c1-13-16(6-7-17(25-13)33(2,28)29)31-20-18(22)19(23-12-24-20)30-14-8-10-26(11-9-14)21(27)32-15-4-3-5-15/h6-7,12,14-15H,3-5,8-11H2,1-2H3
PubChem CID118711784
ChEMBLCHEMBL3326676
IUPHARN/A
BindingDB50056013
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
447271Glucose-dependent insulinotropic receptorQ7TQN8Gpr119Rattus norvegicus (Rat)468
447272Glucose-dependent insulinotropic receptorQ8TDV5GPR119Homo sapiens (Human)335

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