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Name | CHEMBL3597527 |
---|---|
Molecular formula | C33H34ClNO5 |
IUPAC name | 4-[1-(carboxymethyl)-7-[(E)-2-[4-[4-(3-chloro-2-methylphenyl)butoxy]phenyl]ethenyl]indol-3-yl]butanoic acid |
Molecular weight | 560.087 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 7.7 |
Synonyms | 4-(1-Carboxymethyl-7-(4-(4-(2-methyl-3-chlorophenyl)butyloxy)styryl)-1H-indole-3-yl)butyric acid BDBM50104864 |
Inchi Key | BRQUMMADGSMAMB-SAPNQHFASA-N |
Inchi ID | InChI=1S/C33H34ClNO5/c1-23-25(8-5-12-30(23)34)7-2-3-20-40-28-18-15-24(16-19-28)14-17-26-9-4-11-29-27(10-6-13-31(36)37)21-35(33(26)29)22-32(38)39/h4-5,8-9,11-12,14-19,21H,2-3,6-7,10,13,20,22H2,1H3,(H,36,37)(H,38,39)/b17-14+ |
PubChem CID | 122183684 |
ChEMBL | CHEMBL3597527 |
IUPHAR | N/A |
BindingDB | 50104864 |
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 |
---|---|---|---|---|---|
466759 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
466758 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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