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Ligand

NameAC1NK9QQ
Molecular formulaC22H18ClN5O3S
IUPAC name2-[(6-chloro-1H-imidazo[4,5-b]pyridin-2-yl)sulfanyl]-1-[3-(furan-2-yl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-2-yl]ethanone
Molecular weight467.928
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP3.8
SynonymsMLS001061367
CHEMBL1339301
MolPort-004-078-049
HMS2721J07
AKOS033560636
[ Show all ]
Inchi KeyACDJKTUVYHCHQC-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H18ClN5O3S/c1-30-15-6-4-13(5-7-15)16-10-18(19-3-2-8-31-19)28(27-16)20(29)12-32-22-25-17-9-14(23)11-24-21(17)26-22/h2-9,11,18H,10,12H2,1H3,(H,24,25,26)
PubChem CID4884532
ChEMBLCHEMBL1339301
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
1447Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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