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Name | CHEMBL38270 |
---|---|
Molecular formula | C28H21K2NO7 |
IUPAC name | dipotassium;3-[(3-carboxylatophenyl)methyl]-1-[(6-ethyl-1,3-benzodioxol-5-yl)methyl]-4-oxoquinoline-2-carboxylate |
Molecular weight | 561.673 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 0 |
XlogP | None |
Synonyms | 1-(6-Ethyl-1,3-benzodioxole-5-ylmethyl)-3-[3-(potassiooxycarbonyl)benzyl]-4-oxo-1,4-dihydroquinoline-2-carboxylic acid potassium salt |
Inchi Key | AKTRBHNRMNOJHP-UHFFFAOYSA-L |
Inchi ID | InChI=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 CID | 10076526 |
ChEMBL | CHEMBL38270 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. Partition coefficient log P of this ligand is not available. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
7894 | Endothelin receptor type B | P21451 | Ednrb | Rattus norvegicus (Rat) | 442 |
7893 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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