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Ligand

NameMLS003106901
Molecular formulaC12H15NO4
IUPAC nameethyl 5-(3-ethoxy-3-oxoprop-1-enyl)-1H-pyrrole-2-carboxylate
Molecular weight237.255
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP1.9
SynonymsAC1L6Y92
CHEMBL2145100
SMR001821786
ethyl 5-(3-ethoxy-3-oxoprop-1-enyl)-1H-pyrrole-2-carboxylate
Inchi KeyAAJYCHBLTARBTA-UHFFFAOYSA-N
Inchi IDInChI=1S/C12H15NO4/c1-3-16-11(14)8-6-9-5-7-10(13-9)12(15)17-4-2/h5-8,13H,3-4H2,1-2H3
PubChem CID301354
ChEMBLCHEMBL2145100
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
264Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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