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
Sankey plot
Compound is not listed as a drug.
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 |