Ligand Data
Ligand
| Name | CHEMBL3589847 |
| SMILES | O=C(NCc1cc(F)cc(C(F)(F)F)c1)C(CCN1CCC2(CC1)OCCc1ccccc12)c1ccc(F)cc1 |
| InChIKey | PPJHFLILDOHJMC-UHFFFAOYSA-N |
| Type | small-molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 7 |
| Molecular weight | 558.2 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| CCR2 | CCR2 | Mouse | Chemokine | A (Rhodopsin) | 3630 | 3630 | 3630 | |||
| CCR2 | CCR2 | Human | Chemokine | A (Rhodopsin) | 173 | 173 | 173 | |||