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Name | CHEMBL384979 |
---|---|
Molecular formula | C18H12Br2N2O4 |
IUPAC name | 2-[4-bromo-2-[1-(2-bromophenyl)pyrazole-4-carbonyl]phenoxy]acetic acid |
Molecular weight | 480.112 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 4.2 |
Synonyms | BDBM50200265 SCHEMBL1992157 4-bromo-2-[1-(2-bromophenyl)-1H-pyrazole-4-carbonyl]phenoxyacetic acid |
Inchi Key | ABJDYWHACJDHLM-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H12Br2N2O4/c19-12-5-6-16(26-10-17(23)24)13(7-12)18(25)11-8-21-22(9-11)15-4-2-1-3-14(15)20/h1-9H,10H2,(H,23,24) |
PubChem CID | 11511330 |
ChEMBL | CHEMBL384979 |
IUPHAR | N/A |
BindingDB | 50200265 |
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 |
---|---|---|---|---|---|
902 | Prostaglandin D2 receptor 2 | Q9Y5Y4 | PTGDR2 | Homo sapiens (Human) | 395 |
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