You can:
Name | CHEMBL562427 |
---|---|
Molecular formula | C25H27N5O6 |
IUPAC name | 2-[4-[1-ethyl-3-(3-methoxypropyl)-2,6-dioxo-7H-purin-8-yl]phenoxy]-N-(4-hydroxyphenyl)acetamide |
Molecular weight | 493.52 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 3.3 |
Synonyms | BDBM50414360 |
Inchi Key | AKVYMVYDFPHFKS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H27N5O6/c1-3-29-24(33)21-23(30(25(29)34)13-4-14-35-2)28-22(27-21)16-5-11-19(12-6-16)36-15-20(32)26-17-7-9-18(31)10-8-17/h5-12,31H,3-4,13-15H2,1-2H3,(H,26,32)(H,27,28) |
PubChem CID | 45269711 |
ChEMBL | CHEMBL562427 |
IUPHAR | N/A |
BindingDB | 50414360 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
You can:
GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
7946 | Adenosine receptor A1 | P25099 | Adora1 | Rattus norvegicus (Rat) | 326 |
7944 | Adenosine receptor A2a | P29274 | ADORA2A | Homo sapiens (Human) | 412 |
7945 | Adenosine receptor A2b | P29275 | ADORA2B | Homo sapiens (Human) | 332 |
442030 | Adenosine receptor A3 | P0DMS8 | ADORA3 | Homo sapiens (Human) | 318 |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417