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Name | CHEMBL3809230 |
---|---|
Molecular formula | C29H20ClN3O3 |
IUPAC name | 3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid |
Molecular weight | 493.947 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 6.4 |
Synonyms | BDBM50172348 |
Inchi Key | IDMBBLNHFYTANN-CCQVQAEASA-N |
Inchi ID | InChI=1S/C29H20ClN3O3/c30-20-11-9-19-10-13-21(31-26(19)17-20)12-8-18-4-3-5-22(16-18)32-27(34)15-14-24-23-6-1-2-7-25(23)33-28(24)29(35)36/h1-17,33H,(H,32,34)(H,35,36)/b12-8+,15-14+ |
PubChem CID | 127043050 |
ChEMBL | CHEMBL3809230 |
IUPHAR | N/A |
BindingDB | 50172348 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
525293 | Cysteinyl leukotriene receptor 1 | Q99JA4 | Cysltr1 | Mus musculus (Mouse) | 352 |
525294 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
525295 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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