CHEMBL113986
SMILES | CCCCn1c(=O)c2nc(/C=C/C(=O)O)[nH]c2n(CCCC)c1=O |
InChIKey | ZWYGMFUZAACFIF-BQYQJAHWSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 334.2 |
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 | Rat | Adenosine | A | pKi | 4.13 | 4.13 | 4.13 | ChEMBL |
A2A | AA2AR | Rat | Adenosine | A | pKi | 4.78 | 4.78 | 4.78 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 5.47 | 5.47 | 5.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |