CHEMBL2180908
SMILES | CN1CCN(c2nc3nn(C)cc3c3nc(-c4ccco4)nn23)CC1 |
InChIKey | OAXDFZDZMBSVTG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 0 |
Rotatable bonds | 2 |
Molecular weight (Da) | 338.2 |
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 |
A3 | AA3R | Human | Adenosine | A | pKi | 5.88 | 5.88 | 5.88 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.11 | 5.11 | 5.11 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 4.82 | 4.82 | 4.82 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |