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Name | CHEMBL3597522 |
---|---|
Molecular formula | C32H33NO6 |
IUPAC name | 4-[1-(carboxymethyl)-7-[(E)-2-[4-(4-phenoxybutoxy)phenyl]ethenyl]indol-3-yl]butanoic acid |
Molecular weight | 527.617 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 6.4 |
Synonyms | BDBM50104836 SCHEMBL3564281 4-(1-Carboxymethyl-7-(4-(4-phenoxybutyloxy)styryl)-1H-indole-3-yl)butyric acid |
Inchi Key | NTBXOFAJPMVAEU-SAPNQHFASA-N |
Inchi ID | InChI=1S/C32H33NO6/c34-30(35)13-7-9-26-22-33(23-31(36)37)32-25(8-6-12-29(26)32)17-14-24-15-18-28(19-16-24)39-21-5-4-20-38-27-10-2-1-3-11-27/h1-3,6,8,10-12,14-19,22H,4-5,7,9,13,20-21,23H2,(H,34,35)(H,36,37)/b17-14+ |
PubChem CID | 11713438 |
ChEMBL | CHEMBL3597522 |
IUPHAR | N/A |
BindingDB | 50104836 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
491640 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
491639 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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