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Ligand

NameMLS000118524
Molecular formulaC21H25FN4OS
IUPAC name3-(2-fluorophenyl)-1-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]thieno[2,3-c]pyrazole-5-carboxamide
Molecular weight400.516
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.3
SynonymsHMS2252D16
3-(2-fluorophenyl)-1-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]thieno[2,3-c]pyrazole-5-carboxamide
REGID_for_CID_5309938
MCULE-7853037316
AC1NSI0E
[ Show all ]
Inchi KeyACCIYHXMPCYLTP-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25FN4OS/c1-14-7-5-6-11-26(14)12-10-23-20(27)18-13-16-19(24-25(2)21(16)28-18)15-8-3-4-9-17(15)22/h3-4,8-9,13-14H,5-7,10-12H2,1-2H3,(H,23,27)
PubChem CID5309938
ChEMBLCHEMBL1497248
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
1425Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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