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Name | CHEMBL3597632 |
---|---|
Molecular formula | C35H32F5NO5 |
IUPAC name | 4-[1-(3-carboxypropyl)-4-fluoro-2-methyl-7-[2-[4-[4-(2,3,4,6-tetrafluorophenyl)butoxy]phenyl]ethynyl]indol-3-yl]butanoic acid |
Molecular weight | 641.635 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 2 |
XlogP | 7.5 |
Synonyms | BDBM50104919 HOXJOAWSVADHMC-UHFFFAOYSA-N 4,4'-[4-fluoro-2-methyl-7-({4-[4-(2,3,4,6-tetrafluorophenyl)butoxy]phenyl}ethynyl)-1H-indole-1,3-diyl]dibutanoic Acid SCHEMBL598080 |
Inchi Key | HOXJOAWSVADHMC-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C35H32F5NO5/c1-21-25(7-4-8-30(42)43)32-27(36)17-14-23(35(32)41(21)18-5-9-31(44)45)13-10-22-11-15-24(16-12-22)46-19-3-2-6-26-28(37)20-29(38)34(40)33(26)39/h11-12,14-17,20H,2-9,18-19H2,1H3,(H,42,43)(H,44,45) |
PubChem CID | 46830963 |
ChEMBL | CHEMBL3597632 |
IUPHAR | N/A |
BindingDB | 50104919 |
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 |
---|---|---|---|---|---|
477748 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
477749 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
477750 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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