Chembl612216
Chemical Properties
| SMILES | CCNC(=O)[C@H]1OC(n2cnc3c(N)nc(CC4CCC(C(=O)O)CC4)nc32)[C@H](O)[C@@H]1O |
| Hydrogen bond acceptors | 10 |
| Hydrogen bond donors | 5 |
| Rotatable bonds | 6 |
| Molecular weight | 448.2 |
Drug Properties
| Type | Small molecule |
| Endogenous | No |
| Approved | No |
| InChIKey | NGIPWYMHJOWWDB-BVCCDACTSA-N |
Bioactivity
| Receptor | Experimental Data | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A2A | AA2AR | Rat | Adenosine | A | pKi | 7.7 | 7.7 | 7.7 | ChEMBL |
| A1 | AA1R | Rat | Adenosine | A | pKi | 6.54 | 6.54 | 6.54 | ChEMBL |