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Name | CHEMBL27969 |
---|---|
Molecular formula | C12H16N4O3 |
IUPAC name | 1-methyl-7-(2-oxopropyl)-3-propylpurine-2,6-dione |
Molecular weight | 264.285 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 0 |
XlogP | 0.3 |
Synonyms | ACMC-20myhy 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-7-(2-oxopropyl)-3-propyl- XT-136 BDBM50047225 1-Methyl-7-(2-oxo-propyl)-3-propyl-3,7-dihydro-purine-2,6-dione [ Show all ] |
Inchi Key | CZVWOWZGTGEKDQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C12H16N4O3/c1-4-5-16-10-9(11(18)14(3)12(16)19)15(7-13-10)6-8(2)17/h7H,4-6H2,1-3H3 |
PubChem CID | 10445504 |
ChEMBL | CHEMBL27969 |
IUPHAR | N/A |
BindingDB | 50047225 |
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 |
---|---|---|---|---|---|
54714 | Adenosine receptor A1 | P47745 | ADORA1 | Cavia porcellus (Guinea pig) | 326 |
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