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Ligand

NameSMR000154917
Molecular formulaC21H21FN4OS
IUPAC name2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide
Molecular weight396.484
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.9
SynonymsMolPort-004-059-176
790265-70-2
ZINC3390462
MCULE-4517020364
2-[(5-cyclopropyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-fluorophenyl)ethyl]acetamide
[ Show all ]
Inchi KeyAAADJTFUPWEOSD-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H21FN4OS/c22-17-10-6-15(7-11-17)12-13-23-19(27)14-28-21-25-24-20(16-8-9-16)26(21)18-4-2-1-3-5-18/h1-7,10-11,16H,8-9,12-14H2,(H,23,27)
PubChem CID2508673
ChEMBLCHEMBL1337818
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
2Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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