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Ligand

NameCHEMBL64447
Molecular formulaC25H26O7
IUPAC name2-(1,3-benzodioxol-5-yl)-4-pent-4-enoxy-6-propan-2-yloxy-2H-chromene-3-carboxylic acid
Molecular weight438.476
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP4.9
SynonymsBDBM50112667
2-Benzo[1,3]dioxol-5-yl-6-isopropoxy-4-pent-4-enyloxy-2H-chromene-3-carboxylic acid
Inchi KeyDSQSZBYLXUBISF-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H26O7/c1-4-5-6-11-28-24-18-13-17(31-15(2)3)8-10-19(18)32-23(22(24)25(26)27)16-7-9-20-21(12-16)30-14-29-20/h4,7-10,12-13,15,23H,1,5-6,11,14H2,2-3H3,(H,26,27)
PubChem CID11102201
ChEMBLCHEMBL64447
IUPHARN/A
BindingDB50112667
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
67875Endothelin receptor type BP35463EDNRBSus scrofa (Pig)443
67874Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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