CHEMBL3741167
SMILES | CCCn1c(Br)nc2c(NCc3ccccc3)ncnc21 |
InChIKey | NJVWKROFIGALGW-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 345.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 | 5.13 | 5.13 | 5.13 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.93 | 5.93 | 5.93 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 5.25 | 5.25 | 5.25 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |