CHEMBL162665
| SMILES | CCCOC(=O)c1c(-c2ccccc2)nc(CC)c(C(=O)SCC)c1CCSC(C)=O |
| InChIKey | DONYRDTYANPRKL-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 10 |
| Molecular weight (Da) | 459.2 |
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 | Rat | Adenosine | A | pKi | 5.01 | 5.01 | 5.01 | ChEMBL |
| A3 | AA3R | Human | Adenosine | A | pKi | 6.91 | 6.91 | 6.91 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |