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Name | CHEMBL3809556 |
---|---|
Molecular formula | C29H19Cl2N3O3 |
IUPAC name | 5-chloro-3-[(E)-3-[3-[(E)-2-(7-chloroquinolin-2-yl)ethenyl]anilino]-3-oxoprop-1-enyl]-1H-indole-2-carboxylic acid |
Molecular weight | 528.389 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 7.0 |
Synonyms | BDBM50172343 |
Inchi Key | NNGUADDTNRXMDU-VFBBEJETSA-N |
Inchi ID | InChI=1S/C29H19Cl2N3O3/c30-19-8-12-25-24(15-19)23(28(34-25)29(36)37)11-13-27(35)33-22-3-1-2-17(14-22)4-9-21-10-6-18-5-7-20(31)16-26(18)32-21/h1-16,34H,(H,33,35)(H,36,37)/b9-4+,13-11+ |
PubChem CID | 127043241 |
ChEMBL | CHEMBL3809556 |
IUPHAR | N/A |
BindingDB | 50172343 |
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 |
---|---|---|---|---|---|
528049 | Cysteinyl leukotriene receptor 1 | Q9Y271 | CYSLTR1 | Homo sapiens (Human) | 337 |
528050 | Cysteinyl leukotriene receptor 2 | Q9NS75 | CYSLTR2 | Homo sapiens (Human) | 346 |
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