CHEMBL196259
SMILES | Cn1c(-n2nccn2)nc2c(N)nc(CCc3ccccc3)nc21 |
InChIKey | ABAHFXBQXJPKNX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 320.2 |
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 |
A2B | AA2BR | Human | Adenosine | A | pKi | 5.63 | 5.63 | 5.63 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 8.33 | 8.33 | 8.33 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 7.1 | 7.1 | 7.1 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |