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Ligand

NameCHEMBL275701
Molecular formulaC28H26O9
IUPAC name3-(1,3-benzodioxol-5-yl)-5-hydroxy-5-(4-methoxyphenyl)-4-[(2,4,5-trimethoxyphenyl)methyl]furan-2-one
Molecular weight506.507
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP4.0
SynonymsBDBM50057167
SCHEMBL8035297
3-Benzo[1,3]dioxol-5-yl-5-hydroxy-5-(4-methoxy-phenyl)-4-(2,4,5-trimethoxy-benzyl)-5H-furan-2-one
Inchi KeyARCCNAPMMHWOCU-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H26O9/c1-31-19-8-6-18(7-9-19)28(30)20(11-17-13-23(33-3)24(34-4)14-22(17)32-2)26(27(29)37-28)16-5-10-21-25(12-16)36-15-35-21/h5-10,12-14,30H,11,15H2,1-4H3
PubChem CID10601668
ChEMBLCHEMBL275701
IUPHARN/A
BindingDB50057167
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
12288Endothelin receptor type BP24530EDNRBHomo sapiens (Human)442
12289Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427

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