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Name | CHEMBL3597631 |
---|---|
Molecular formula | C35H33F4NO5 |
IUPAC name | 4-[1-(3-carboxypropyl)-2-methyl-7-[2-[4-[4-(2,3,4,6-tetrafluorophenyl)butoxy]phenyl]ethynyl]indol-3-yl]butanoic acid |
Molecular weight | 623.645 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 7.4 |
Synonyms | BDBM50104918 SCHEMBL597729 |
Inchi Key | HUIIHFBKBWWWJM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C35H33F4NO5/c1-22-26(9-5-11-31(41)42)27-10-4-7-24(35(27)40(22)19-6-12-32(43)44)16-13-23-14-17-25(18-15-23)45-20-3-2-8-28-29(36)21-30(37)34(39)33(28)38/h4,7,10,14-15,17-18,21H,2-3,5-6,8-9,11-12,19-20H2,1H3,(H,41,42)(H,43,44) |
PubChem CID | 46830677 |
ChEMBL | CHEMBL3597631 |
IUPHAR | N/A |
BindingDB | 50104918 |
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 |
---|---|---|---|---|---|
478242 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
478243 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
478241 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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