CHEMBL3753339
SMILES | Nc1nc(-c2ccccc2)cc(-c2cccc(OC(=O)N3CCCCC3)c2)n1 |
InChIKey | YRHUKOHIJREPRH-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 374.2 |
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 |
A2A | AA2AR | Rat | Adenosine | A | pKi | 8.05 | 8.05 | 8.05 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 8.71 | 8.71 | 8.71 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.71 | 5.71 | 5.71 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.45 | 5.45 | 5.45 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |