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Name | CHEMBL312707 |
---|---|
Molecular formula | C27H31NO7S |
IUPAC name | 7-[(1S,2R,3R,4R)-3-[(2-methoxydibenzofuran-3-yl)sulfonylamino]-2-bicyclo[2.2.1]heptanyl]-6-oxoheptanoic acid |
Molecular weight | 513.605 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 4.0 |
Synonyms | 7-[3-(2-Methoxy-dibenzofuran-3-sulfonylamino)-bicyclo[2.2.1]hept-2-yl]-6-oxo-heptanoic acid BDBM50128731 |
Inchi Key | AGEJSDATIXGYNN-VTKXYJJGSA-N |
Inchi ID | InChI=1S/C27H31NO7S/c1-34-24-14-21-19-7-3-4-8-22(19)35-23(21)15-25(24)36(32,33)28-27-17-11-10-16(12-17)20(27)13-18(29)6-2-5-9-26(30)31/h3-4,7-8,14-17,20,27-28H,2,5-6,9-13H2,1H3,(H,30,31)/t16-,17+,20+,27+/m0/s1 |
PubChem CID | 10874929 |
ChEMBL | CHEMBL312707 |
IUPHAR | N/A |
BindingDB | 50128731 |
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 |
---|---|---|---|---|---|
4802 | Prostaglandin D2 receptor | Q13258 | PTGDR | Homo sapiens (Human) | 359 |
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