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Name | CHEMBL2112076 |
---|---|
Molecular formula | C10H12ClN5O4 |
IUPAC name | (2R,3S,4S,5R)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol |
Molecular weight | 301.687 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 4 |
XlogP | -0.1 |
Synonyms | ZINC12405882 6-Amino-2-chloro-9-beta-D-arabinofuranosyl-9H-purine BDBM50453673 SCHEMBL1389446 |
Inchi Key | BIXYYZIIJIXVFW-FJFJXFQQSA-N |
Inchi ID | InChI=1S/C10H12ClN5O4/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,14,15)/t3-,5-,6+,9-/m1/s1 |
PubChem CID | 9879442 |
ChEMBL | CHEMBL2112076 |
IUPHAR | N/A |
BindingDB | 50453673 |
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 |
---|---|---|---|---|---|
24835 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
24834 | Adenosine receptor A2a | P30543 | Adora2a | Rattus norvegicus (Rat) | 410 |
24836 | Adenosine receptor A3 | P28647 | Adora3 | Rattus norvegicus (Rat) | 320 |
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