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Ligand

NameCHEMBL274370
Molecular formulaC24H19NO6
IUPAC name1-(1,3-benzodioxol-5-yl)-5-methoxy-3-(4-methoxyphenyl)indole-2-carboxylic acid
Molecular weight417.417
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.9
SynonymsBDBM50289238
1-Benzo[1,3]dioxol-5-yl-5-methoxy-3-(4-methoxy-phenyl)-1H-indole-2-carboxylic acid
Inchi KeyALNZRBOFBJCSQN-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H19NO6/c1-28-16-6-3-14(4-7-16)22-18-12-17(29-2)8-9-19(18)25(23(22)24(26)27)15-5-10-20-21(11-15)31-13-30-20/h3-12H,13H2,1-2H3,(H,26,27)
PubChem CID44266565
ChEMBLCHEMBL274370
IUPHARN/A
BindingDB50289238
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
8439Endothelin receptor type BP24530EDNRBHomo sapiens (Human)442
8440Endothelin-1 receptorP25101EDNRAHomo sapiens (Human)427

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