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Ligand

NameMLS000560771
Molecular formulaC16H16N2O4S
IUPAC name3-[(3-methylphenyl)sulfanylmethyl]-5-(prop-2-enylcarbamoyl)-1,2-oxazole-4-carboxylic acid
Molecular weight332.374
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP2.6
SynonymsSMR000155785
CHEMBL1386933
3-(3-Methylphenylthiomethyl)-5-(allylcarbamoyl)isoxazole-4-carboxylic acid
Inchi KeyAEZZEGBJSQKLSU-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H16N2O4S/c1-3-7-17-15(19)14-13(16(20)21)12(18-22-14)9-23-11-6-4-5-10(2)8-11/h3-6,8H,1,7,9H2,2H3,(H,17,19)(H,20,21)
PubChem CID11958659
ChEMBLCHEMBL1386933
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
3984Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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