CHEMBL488367
SMILES | Cn1c(=O)c2[nH]c(-c3cccc(OCCN4CCOCC4)c3)nc2n(C)c1=O |
InChIKey | DKGCSVKNSVZVMO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 385.2 |
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 | Human | Adenosine | A | pKi | 5.85 | 5.85 | 5.85 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.68 | 5.68 | 5.68 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |