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Ligand

NameMLS000520884
Molecular formulaC18H25N3O2S2
IUPAC name3-butyl-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylthieno[3,2-d]pyrimidin-4-one
Molecular weight379.537
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP3.9
SynonymsAC1MUQ1I
Oprea1_372724
CHEMBL1610285
REGID_for_CID_3644807
HMS2395B09
[ Show all ]
Inchi KeyAHVKTIGDXSQSKU-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H25N3O2S2/c1-3-4-8-21-17(23)16-14(7-11-24-16)19-18(21)25-12-15(22)20-9-5-13(2)6-10-20/h7,11,13H,3-6,8-10,12H2,1-2H3
PubChem CID3644807
ChEMBLCHEMBL1610285
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
5912Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
5911Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371

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