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Name | CHEMBL373752 |
---|---|
Molecular formula | C13H12O5 |
IUPAC name | 5-(3-methoxyphenyl)-5-methyl-4-oxofuran-2-carboxylic acid |
Molecular weight | 248.234 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 1.6 |
Synonyms | BDBM50208117 SCHEMBL3107739 5-(3-methoxy-phenyl)-5-methyl-4-oxo-4,5-dihydro-furan-2-carboxylic acid |
Inchi Key | KJRXFRPWDMVTLR-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C13H12O5/c1-13(8-4-3-5-9(6-8)17-2)11(14)7-10(18-13)12(15)16/h3-7H,1-2H3,(H,15,16) |
PubChem CID | 11390981 |
ChEMBL | CHEMBL373752 |
IUPHAR | N/A |
BindingDB | 50208117 |
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 |
---|---|---|---|---|---|
170782 | Hydroxycarboxylic acid receptor 2 | Q8TDS4 | HCAR2 | Homo sapiens (Human) | 363 |
170783 | Hydroxycarboxylic acid receptor 3 | P49019 | HCAR3 | Homo sapiens (Human) | 387 |
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