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Name | CHEMBL307105 |
---|---|
Molecular formula | C19H23ClN4O2 |
IUPAC name | 7-(2-chloroethyl)-8-phenyl-1,3-dipropylpurine-2,6-dione |
Molecular weight | 374.869 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 0 |
XlogP | 3.5 |
Synonyms | BDBM50113239 7-(2-Chloro-ethyl)-8-phenyl-1,3-dipropyl-3,7-dihydro-purine-2,6-dione |
Inchi Key | QITWXKORLMEMBF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H23ClN4O2/c1-3-11-23-17-15(18(25)24(12-4-2)19(23)26)22(13-10-20)16(21-17)14-8-6-5-7-9-14/h5-9H,3-4,10-13H2,1-2H3 |
PubChem CID | 10861697 |
ChEMBL | CHEMBL307105 |
IUPHAR | N/A |
BindingDB | 50113239 |
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 |
---|---|---|---|---|---|
279340 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
279339 | Adenosine receptor A2a | P30543 | Adora2a | Rattus norvegicus (Rat) | 410 |
279337 | Adenosine receptor A2b | P29276 | Adora2b | Rattus norvegicus (Rat) | 332 |
279338 | Adenosine receptor A2b | P29275 | ADORA2B | Homo sapiens (Human) | 332 |
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