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Name | CHEMBL129272 |
---|---|
Molecular formula | C33H30O7 |
IUPAC name | 3-[3-[3-(2-ethyl-5-hydroxy-4-phenylphenoxy)propoxy]-9-oxoxanthen-4-yl]propanoic acid |
Molecular weight | 538.596 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 6.8 |
Synonyms | 3-[3-(2-Ethyl-4-phenyl-5-hydroxyphenoxy)propoxy]-9-oxo-9H-xanthene-4-propanoic acid BDBM50029448 3-{3-[3-(5-Ethyl-2-hydroxy-biphenyl-4-yloxy)-propoxy]-9-oxo-9H-xanthen-4-yl}-propionic acid |
Inchi Key | AZXAHRBQFLYINX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C33H30O7/c1-2-21-19-26(22-9-4-3-5-10-22)27(34)20-30(21)39-18-8-17-38-28-15-13-25-32(37)23-11-6-7-12-29(23)40-33(25)24(28)14-16-31(35)36/h3-7,9-13,15,19-20,34H,2,8,14,16-18H2,1H3,(H,35,36) |
PubChem CID | 11800543 |
ChEMBL | CHEMBL129272 |
IUPHAR | N/A |
BindingDB | 50029448 |
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 |
---|---|---|---|---|---|
18553 | Leukotriene B4 receptor 1 | Q15722 | LTB4R | Homo sapiens (Human) | 352 |
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