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Name | CID 632916 |
---|---|
Molecular formula | C18H20N4O5 |
IUPAC name | 1,3-dimethyl-8-[2-(3,4,5-trimethoxyphenyl)ethenyl]-7H-purine-2,6-dione |
Molecular weight | 372.381 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 1.8 |
Synonyms | N/A |
Inchi Key | BPIQNFNKBYWCNB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H20N4O5/c1-21-16-14(17(23)22(2)18(21)24)19-13(20-16)7-6-10-8-11(25-3)15(27-5)12(9-10)26-4/h6-9H,1-5H3,(H,19,20) |
PubChem CID | 632916 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50006716 |
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 |
---|---|---|---|---|---|
29615 | Adenosine receptor A1 | P47745 | ADORA1 | Cavia porcellus (Guinea pig) | 326 |
29616 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
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