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Name | CHEMBL2070507 |
---|---|
Molecular formula | C14H18N6O4 |
IUPAC name | (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-N-cyclobutyl-3,4-dihydroxyoxolane-2-carboxamide |
Molecular weight | 334.336 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 4 |
XlogP | -0.1 |
Synonyms | BDBM50389798 5'-Oxo-5'-(cyclobutylamino)-5'-deoxyadenosine |
Inchi Key | CGYRWWMWNACLSU-AEISUSGSSA-N |
Inchi ID | InChI=1S/C14H18N6O4/c15-11-7-12(17-4-16-11)20(5-18-7)14-9(22)8(21)10(24-14)13(23)19-6-2-1-3-6/h4-6,8-10,14,21-22H,1-3H2,(H,19,23)(H2,15,16,17)/t8-,9+,10-,14+/m0/s1 |
PubChem CID | 10449535 |
ChEMBL | CHEMBL2070507 |
IUPHAR | N/A |
BindingDB | 50389798 |
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 |
---|---|---|---|---|---|
41758 | 2-oxoglutarate receptor 1 | Q6Y1R5 | Oxgr1 | Rattus norvegicus (Rat) | 337 |
41756 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
41761 | Adenosine receptor A1 | P30542 | ADORA1 | Homo sapiens (Human) | 326 |
41757 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
41759 | Adenosine receptor A2a | P30543 | Adora2a | Rattus norvegicus (Rat) | 410 |
41760 | Adenosine receptor A2b | P29275 | ADORA2B | Homo sapiens (Human) | 332 |
443345 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
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