Ligand Data
Ligand
| Name | CHEMBL240249 |
| SMILES | CN(CCCN1CC(OC1=O)C2=C3C=C(C=CC3=NC=C2)OC)CC4=CC5=CC=CC=C5N4 |
| InChIKey | AEAOMQAWGDKZCV-UHFFFAOYSA-N |
| Type | small molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight | 444.5 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| CCR8 | ccr8_human | Human | Chemokine receptors | Class A (Rhodopsin) | 6309.57 | 6309.57 | 6309.57 | |||