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Name | CHEMBL559928 |
---|---|
Molecular formula | C32H26ClN3O3 |
IUPAC name | 3-[5-[[2-(7-chloroquinolin-2-yl)-1-benzofuran-5-yl]methyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-yl]propanoic acid |
Molecular weight | 536.028 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.7 |
Synonyms | 3-(5-((2-(7-chloroquinolin-2-yl)benzofuran-5-yl)methyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)propanoic acid BDBM50296116 |
Inchi Key | ABOXSYZUZSDMTI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H26ClN3O3/c33-23-8-6-21-7-9-26(34-27(21)17-23)31-16-22-15-20(5-10-30(22)39-31)18-36-28-4-2-1-3-24(28)25-19-35(13-11-29(25)36)14-12-32(37)38/h1-10,15-17H,11-14,18-19H2,(H,37,38) |
PubChem CID | 45268266 |
ChEMBL | CHEMBL559928 |
IUPHAR | N/A |
BindingDB | 50296116 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
1050 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
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