Ligand Data
Ligand
| Name | ICI198615 |
| SMILES | COc1cc(ccc1Cn1ncc2c1cc(cc2)NC(=O)OC1CCCC1)C(=O)NS(=O)(=O)c1ccccc1 |
| InChIKey | YRCPIXCRSAKRGM-UHFFFAOYSA-N |
| Type | small-molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 2 |
| Rotatable bonds | 8 |
| Molecular weight | 548.2 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| CysLT1 | CLTR1 | Guinea pig | Leukotriene | A (Rhodopsin) | 0.3 | 15050.1 | 30100.0 | |||