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Name | CHEMBL157742 |
---|---|
Molecular formula | C27H21NO6 |
IUPAC name | 4-(4-methoxyphenyl)-1-[(2-methoxyphenyl)methyl]-2-oxo-[1]benzofuro[3,2-b]pyridine-3-carboxylic acid |
Molecular weight | 455.466 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.9 |
Synonyms | 1-(2-Methoxybenzyl)-2-oxo-4-(4-methoxyphenyl)-1,2-dihydrobenzofuro[3,2-b]pyridine-3-carboxylic acid 1-(2-Methoxy-benzyl)-4-(4-methoxy-phenyl)-2-oxo-1,2-dihydro-benzo[4,5]furo[3,2-b]pyridine-3-carboxylic acid BDBM50075417 SCHEMBL6314933 |
Inchi Key | BBQVZZLPYFHCQZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H21NO6/c1-32-18-13-11-16(12-14-18)22-23(27(30)31)26(29)28(15-17-7-3-5-9-20(17)33-2)24-19-8-4-6-10-21(19)34-25(22)24/h3-14H,15H2,1-2H3,(H,30,31) |
PubChem CID | 10173807 |
ChEMBL | CHEMBL157742 |
IUPHAR | N/A |
BindingDB | 50075417 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
19765 | Endothelin receptor type B | P24530 | EDNRB | Homo sapiens (Human) | 442 |
19764 | Endothelin-1 receptor | P26684 | Ednra | Rattus norvegicus (Rat) | 426 |
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