CHEMBL280982
SMILES | COc1ccc(/C=C/c2nc3c(c(=O)n(C)c(=O)n3C)n2C)cc1OC |
InChIKey | QTVJUPYVJXQCDT-VQHVLOKHSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 0 |
Rotatable bonds | 4 |
Molecular weight (Da) | 356.1 |
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 |
A2A | AA2AR | Rat | Adenosine | A | pKi | 7.75 | 7.75 | 7.75 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 4.86 | 4.91 | 5.02 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |