CHEMBL4760108
SMILES | O=C(O)c1ccc(Oc2ccc(Cl)cc2NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1 |
InChIKey | SEXCSTOTDUMWPC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 6 |
Molecular weight (Da) | 471.0 |
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 |
CCR2 | CCR2 | Human | Chemokine | A | pKi | 8.2 | 8.27 | 8.4 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
CCR2 | CCR2 | Human | Chemokine | A | pIC50 | 6.99 | 7.45 | 7.92 | ChEMBL |
CCR5 | CCR5 | Human | Chemokine | A | pIC50 | 5.4 | 5.4 | 5.4 | ChEMBL |
CCR1 | CCR1 | Human | Chemokine | A | pIC50 | 5.3 | 5.3 | 5.3 | ChEMBL |