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Name | 1,3-Dipropyl-8-phenylxanthine |
---|---|
Molecular formula | C17H20N4O2 |
IUPAC name | 8-phenyl-1,3-dipropyl-7H-purine-2,6-dione |
Molecular weight | 312.373 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 1 |
XlogP | 4.0 |
Synonyms | 85872-53-3 BRD-K41853443-001-02-9 HMS3266E16 SCHEMBL12648449 3,7-Dihydro-1,3-dipropyl-8-phenyl-1H-purine-2,6,dione [ Show all ] |
Inchi Key | CLIGSMOZKDCDRZ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C17H20N4O2/c1-3-10-20-15-13(16(22)21(11-4-2)17(20)23)18-14(19-15)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,18,19) |
PubChem CID | 128784 |
ChEMBL | CHEMBL158507 |
IUPHAR | N/A |
BindingDB | 82025 |
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 |
---|---|---|---|---|---|
44738 | Adenosine receptor A1 | P28190 | ADORA1 | Bos taurus (Bovine) | 326 |
44739 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
44740 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
44742 | Adenosine receptor A2a | P46616 | ADORA2A | Cavia porcellus (Guinea pig) | 409 |
44743 | Adenosine receptor A2a | P30543 | Adora2a | Rattus norvegicus (Rat) | 410 |
44741 | Adenosine receptor A2b | P29275 | ADORA2B | Homo sapiens (Human) | 332 |
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