CHEMBL259607
SMILES | N#Cc1c(-c2ccccc2)nc(N)nc1-c1ccc2c(c1)OCO2 |
InChIKey | GBQXIYDOPGLBKE-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 2 |
Molecular weight (Da) | 316.1 |
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 |
A2B | AA2BR | Human | Adenosine | A | pKi | 7.36 | 7.36 | 7.36 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 7.99 | 8.13 | 8.28 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 8.74 | 8.75 | 8.76 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |