Chembl4466765
Chemical Properties
| SMILES | CCCn1c(=O)[nH]c2nc(-c3ccc(S(=O)(=O)N4CCN(c5cccc(F)c5)CC4)cc3)[nH]c2c1=O |
| Hydrogen bond acceptors | 7 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 6 |
| Molecular weight | 512.2 |
Drug Properties
| Type | Small molecule |
| Endogenous | No |
| Approved | No |
| InChIKey | JHUYIQLRZAAXKR-UHFFFAOYSA-N |
Bioactivity
| Receptor | Experimental Data | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| A2B | AA2BR | Mouse | Adenosine | A | pKi | 9.03 | 9.03 | 9.03 | ChEMBL |
| A2B | AA2BR | Human | Adenosine | A | pKi | 9.2 | 9.2 | 9.2 | ChEMBL |