2-chloro-N6-cyclopentyladenosine
| SMILES | C1CCC(C1)NC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)Cl |
| InChIKey | XSMYYYQVWPZWIZ-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 369.1 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A1 | AA1R | Rat | Adenosine | A | pKi | 9.22 | 9.22 | 9.22 | PDSP Ki database |
| A3 | AA3R | Rat | Adenosine | A | pKi | 6.63 | 6.63 | 6.63 | PDSP Ki database |
| A2A | AA2AR | Rat | Adenosine | A | pKi | 6.02 | 6.02 | 6.02 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |