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Ligand

NameMLS002166510
Molecular formulaC24H26O7
IUPAC name(2-oxooxolan-3-yl) 2-(3,4-dipropoxybenzoyl)benzoate
Molecular weight426.465
Hydrogen bond acceptor7
Hydrogen bond donor0
XlogP4.9
Synonyms(2-oxidanylideneoxolan-3-yl) 2-(3,4-dipropoxyphenyl)carbonylbenzoate
(2-oxooxolan-3-yl) 2-(3,4-dipropoxybenzoyl)benzoate
2-(3,4-dipropoxybenzoyl)benzoic acid (2-ketotetrahydrofuran-3-yl) ester
2-[(3,4-dipropoxyphenyl)-oxomethyl]benzoic acid (2-oxo-3-oxolanyl) ester
AC1NNCSR
[ Show all ]
Inchi KeyAPUOHHVGNOQUIR-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H26O7/c1-3-12-28-19-10-9-16(15-21(19)29-13-4-2)22(25)17-7-5-6-8-18(17)23(26)31-20-11-14-30-24(20)27/h5-10,15,20H,3-4,11-14H2,1-2H3
PubChem CID5024835
ChEMBLCHEMBL1483683
IUPHARN/A
BindingDB79595
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
11387Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
11386Melanocortin receptor 4P32245MC4RHomo sapiens (Human)332
11385Neurotensin receptor type 1P30989NTSR1Homo sapiens (Human)418

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