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Name | 1,3-Diethylxanthine |
---|---|
Molecular formula | C9H12N4O2 |
IUPAC name | 1,3-diethyl-7H-purine-2,6-dione |
Molecular weight | 208.221 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 0.9 |
Synonyms | NSC515479 1,3-diethyl-3,9-dihydro-1h-purine-2,6-dione 5169-95-9 CHEMBL416013 SCHEMBL515564 [ Show all ] |
Inchi Key | GIMNFISWKTZFKJ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C9H12N4O2/c1-3-12-7-6(10-5-11-7)8(14)13(4-2)9(12)15/h5H,3-4H2,1-2H3,(H,10,11) |
PubChem CID | 101420 |
ChEMBL | CHEMBL416013 |
IUPHAR | N/A |
BindingDB | 82021 |
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 |
---|---|---|---|---|---|
97352 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
97353 | Adenosine receptor A2a | P46616 | ADORA2A | Cavia porcellus (Guinea pig) | 409 |
555836 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
97354 | Adenosine receptor A2b | P29275 | ADORA2B | Homo sapiens (Human) | 332 |
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