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Name | 3-acetyl-7-hydroxy-2H-chromen-2-one |
---|---|
Molecular formula | C11H8O4 |
IUPAC name | 3-acetyl-7-hydroxychromen-2-one |
Molecular weight | 204.181 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 1.4 |
Synonyms | 2H-1-Benzopyran-2-one, 3-acetyl-7-hydroxy- 3-acetyl-7-hydroxy-chromen-2-one ,98% AC1NU0NR BRQZHMHHZLRXOO-UHFFFAOYSA-N DB-059132 [ Show all ] |
Inchi Key | BRQZHMHHZLRXOO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C11H8O4/c1-6(12)9-4-7-2-3-8(13)5-10(7)15-11(9)14/h2-5,13H,1H3 |
PubChem CID | 5392139 |
ChEMBL | CHEMBL153064 |
IUPHAR | N/A |
BindingDB | 50096008 |
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 |
---|---|---|---|---|---|
31271 | Sphingosine 1-phosphate receptor 1 | P21453 | S1PR1 | Homo sapiens (Human) | 382 |
31272 | Sphingosine 1-phosphate receptor 4 | O95977 | S1PR4 | Homo sapiens (Human) | 384 |
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