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Name | CHEMBL283412 |
---|---|
Molecular formula | C11H16N4O2 |
IUPAC name | 7-ethyl-1-methyl-3-propylpurine-2,6-dione |
Molecular weight | 236.275 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 0.7 |
Synonyms | BDBM50001496 1-Methyl-3-propyl-7-ethylxanthine 135462-18-9 7-Ethyl-1-methyl-3-propyl-3,7-dihydro-purine-2,6-dione 1H-Purine-2,6-dione, 7-ethyl-3,7-dihydro-1-methyl-3-propyl- |
Inchi Key | MBUIHYBKDMAGEF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C11H16N4O2/c1-4-6-15-9-8(14(5-2)7-12-9)10(16)13(3)11(15)17/h7H,4-6H2,1-3H3 |
PubChem CID | 10243194 |
ChEMBL | CHEMBL283412 |
IUPHAR | N/A |
BindingDB | 50001496 |
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 |
---|---|---|---|---|---|
201660 | Adenosine receptor A1 | P47745 | ADORA1 | Cavia porcellus (Guinea pig) | 326 |
201658 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
201659 | Adenosine receptor A2a | P46616 | ADORA2A | Cavia porcellus (Guinea pig) | 409 |
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