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Name | FK-838 |
---|---|
Molecular formula | C21H18N4O3 |
IUPAC name | 4-[6-oxo-3-(2-phenylpyrazolo[1,5-a]pyridin-3-yl)pyridazin-1-yl]butanoic acid |
Molecular weight | 374.4 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 2.1 |
Synonyms | L004106 131185-37-0 AC1MHZMV D0EK6D 4-[6-Oxo-3-(2-phenyl-pyrazolo[1,5-a]pyridin-3-yl)-6H-pyridazin-1-yl]-butyric acid [ Show all ] |
Inchi Key | FKJPZJACCBMNKZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C21H18N4O3/c26-18-12-11-16(22-25(18)14-6-10-19(27)28)20-17-9-4-5-13-24(17)23-21(20)15-7-2-1-3-8-15/h1-5,7-9,11-13H,6,10,14H2,(H,27,28) |
PubChem CID | 3035594 |
ChEMBL | CHEMBL292917 |
IUPHAR | N/A |
BindingDB | 50079654 |
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 |
---|---|---|---|---|---|
80514 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
80516 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
80517 | Adenosine receptor A1 | Q60612 | Adora1 | Mus musculus (Mouse) | 326 |
80518 | Adenosine receptor A1 | P28190 | ADORA1 | Bos taurus (Bovine) | 326 |
537969 | Adenosine receptor A1 | P47745 | ADORA1 | Cavia porcellus (Guinea pig) | 326 |
80515 | Adenosine receptor A2a | P30543 | Adora2a | Rattus norvegicus (Rat) | 410 |
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