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Name | CHEMBL37338 |
---|---|
Molecular formula | C27H19ClKNO7 |
IUPAC name | potassium;1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-[(3-methoxycarbonylphenyl)methyl]-4-oxoquinoline-2-carboxylate |
Molecular weight | 543.997 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 0 |
XlogP | None |
Synonyms | 1-(6-Chloro-1,3-benzodioxole-5-ylmethyl)-3-[3-(methoxycarbonyl)benzyl]-4-oxo-1,4-dihydroquinoline-2-carboxylic acid potassium salt |
Inchi Key | CZRGJGXEHXIYNC-UHFFFAOYSA-M |
Inchi ID | InChI=1S/C27H20ClNO7.K/c1-34-27(33)16-6-4-5-15(9-16)10-19-24(26(31)32)29(21-8-3-2-7-18(21)25(19)30)13-17-11-22-23(12-20(17)28)36-14-35-22;/h2-9,11-12H,10,13-14H2,1H3,(H,31,32);/q;+1/p-1 |
PubChem CID | 44283736 |
ChEMBL | CHEMBL37338 |
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 |
---|---|---|---|---|---|
54577 | Endothelin receptor type B | P21451 | Ednrb | Rattus norvegicus (Rat) | 442 |
54578 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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