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Ligand

NameCHEMBL38270
Molecular formulaC28H21K2NO7
IUPAC namedipotassium;3-[(3-carboxylatophenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxoquinoline-2-carboxylate
Molecular weight561.673
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogPNone
Synonyms1-(6-Ethyl-1,3-benzodioxole-5-ylmethyl)-3-[3-(potassiooxycarbonyl)benzyl]-4-oxo-1,4-dihydroquinoline-2-carboxylic acid potassium salt
Inchi KeyAKTRBHNRMNOJHP-UHFFFAOYSA-L
Inchi IDInChI=1S/C28H23NO7.2K/c1-2-17-12-23-24(36-15-35-23)13-19(17)14-29-22-9-4-3-8-20(22)26(30)21(25(29)28(33)34)11-16-6-5-7-18(10-16)27(31)32;;/h3-10,12-13H,2,11,14-15H2,1H3,(H,31,32)(H,33,34);;/q;2*+1/p-2
PubChem CID10076526
ChEMBLCHEMBL38270
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
7894Endothelin receptor type BP21451EdnrbRattus norvegicus (Rat)442
7893Endothelin-1 receptorP26684EdnraRattus norvegicus (Rat)426

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