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Name | CHEMBL1099332 |
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Molecular formula | C34H37NO6S |
IUPAC name | 4-[2-(2-carboxyethyl)-3-[6-(3-pyridin-4-yl-5-thiophen-3-ylphenoxy)hexyl]phenoxy]butanoic acid |
Molecular weight | 587.731 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 7.1 |
Synonyms | BDBM50317632 FBSYEMBBPSTFMK-UHFFFAOYSA-N 4-{2-(2-Carboxy-ethyl)-3-[6-(3-pyridin-4-yl-5-thiophen-3-yl-phenoxy)-hexyl]-phenoxy}-butyric acid SCHEMBL1689644 |
Inchi Key | FBSYEMBBPSTFMK-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C34H37NO6S/c36-33(37)10-6-19-41-32-9-5-8-26(31(32)11-12-34(38)39)7-3-1-2-4-18-40-30-22-28(25-13-16-35-17-14-25)21-29(23-30)27-15-20-42-24-27/h5,8-9,13-17,20-24H,1-4,6-7,10-12,18-19H2,(H,36,37)(H,38,39) |
PubChem CID | 25191880 |
ChEMBL | CHEMBL1099332 |
IUPHAR | N/A |
BindingDB | 50317632 |
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 |
---|---|---|---|---|---|
74547 | Leukotriene B4 receptor 1 | Q15722 | LTB4R | Homo sapiens (Human) | 352 |
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