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 |