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Name | CHEMBL3810210 |
---|---|
Molecular formula | C30H22ClN3O4 |
IUPAC name | 3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-7-methoxy-1H-indole-2-carboxylic acid |
Molecular weight | 523.973 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 6.3 |
Synonyms | BDBM50172335 |
Inchi Key | BCDSYHCOCSCCQZ-CCQVQAEASA-N |
Inchi ID | InChI=1S/C30H22ClN3O4/c1-38-26-7-3-6-23-24(29(30(36)37)34-28(23)26)14-15-27(35)33-22-5-2-4-18(16-22)8-12-21-13-10-19-9-11-20(31)17-25(19)32-21/h2-17,34H,1H3,(H,33,35)(H,36,37)/b12-8+,15-14+ |
PubChem CID | 127043618 |
ChEMBL | CHEMBL3810210 |
IUPHAR | N/A |
BindingDB | 50172335 |
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 |
---|---|---|---|---|---|
522052 | Cysteinyl leukotriene receptor 1 | Q99JA4 | Cysltr1 | Mus musculus (Mouse) | 352 |
522053 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
522054 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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