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Name | CHEMBL562575 |
---|---|
Molecular formula | C32H30ClN3O2 |
IUPAC name | 3-[5-[[3-[2-(7-chloroquinolin-2-yl)ethyl]phenyl]methyl]-3,4-dihydro-1H-pyrido[4,3-b]indol-2-yl]propanoic acid |
Molecular weight | 524.061 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 3.9 |
Synonyms | 3-(5-(3-(2-(7-chloroquinolin-2-yl)ethyl)benzyl)-3,4-dihydro-1H-pyrido[4,3-b]indol-2(5H)-yl)propanoic acid BDBM50296091 |
Inchi Key | BTFZAIIGZOLWHN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H30ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-21-35(16-14-31(28)36)17-15-32(37)38/h1-7,9-11,13,18-19H,8,12,14-17,20-21H2,(H,37,38) |
PubChem CID | 45270792 |
ChEMBL | CHEMBL562575 |
IUPHAR | N/A |
BindingDB | 50296091 |
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 |
---|---|---|---|---|---|
32303 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
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