CHEMBL5757743
| SMILES | CCNc1nc(N=[N+]=[N-])nc2c1ncn2[C@@H]1C2C[C@]2(C(=O)NC)C(O)[C@H]1O |
| InChIKey | PTUDMJSZIVMQLL-DLVSGEEMSA-N |
Chemical properties
| Hydrogen bond acceptors | 9 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 373.2 |
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 | Human | Adenosine | A | pKi | 6.15 | 6.15 | 6.15 | ChEMBL |
| A3 | AA3R | Human | Adenosine | A | pKi | 9.22 | 9.22 | 9.22 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |