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Name | L-644698 |
---|---|
Molecular formula | C21H31NO4S |
IUPAC name | 4-[3-[3-(3-hydroxyoctyl)-4-oxo-1,3-thiazolidin-2-yl]propyl]benzoic acid |
Molecular weight | 393.542 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 2 |
XlogP | 4.6 |
Synonyms | L000334 CHEMBL117168 SCHEMBL10789601 L-644,698 4-[3-[3-(3-hydroxyoctyl)-4-oxo-1,3-thiazolidin-2-yl]propyl]benzoic Acid [ Show all ] |
Inchi Key | NDAXAJCKSWCWQI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H31NO4S/c1-2-3-4-7-18(23)13-14-22-19(24)15-27-20(22)8-5-6-16-9-11-17(12-10-16)21(25)26/h9-12,18,20,23H,2-8,13-15H2,1H3,(H,25,26) |
PubChem CID | 9908595 |
ChEMBL | N/A |
IUPHAR | 1879 |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
554367 | Prostaglandin D2 receptor | Q9R261 | Ptgdr | Rattus norvegicus (Rat) | 357 |
554368 | Prostaglandin D2 receptor | Q13258 | PTGDR | Homo sapiens (Human) | 359 |
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