CHEMBL1406895
| SMILES | COC(=O)C1=NN(C(=O)c2cccc(Br)c2)C(O)(c2ccc(Cl)cc2)C1 |
| InChIKey | SQBIDZGSWLVWJR-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 436.0 |
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 |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| CXCR5 | CXCR5 | Human | Chemokine | A | pIC50 | 4.89 | 4.89 | 4.89 | ChEMBL |
| CCR6 | CCR6 | Human | Chemokine | A | pIC50 | 4.85 | 4.86 | 4.86 | ChEMBL |
| apelin | APJ | Human | Apelin | A | pIC50 | 4.92 | 4.92 | 4.92 | ChEMBL |