4941 : (2R)-3-[4-[(E)-5-[4-[(E)-5-[4-[(2R)-2-carboxy-2-ethoxyethyl]phenoxy]pent-3-en-1-ynyl]phenyl]pent-2-en-4-ynoxy]phenyl]-2-ethoxypropanoic acid
Ligand Basic Message
| Ligand | Scaffold |
|---|---|
 |  |
| ID | 4941 |
| Name | (2R)-3-[4-[(E)-5-[4-[(E)-5-[4-[(2R)-2-carboxy-2-ethoxyethyl]phenoxy]pent-3-en-1-ynyl]phenyl]pent-2-en-4-ynoxy]phenyl]-2-ethoxypropanoic acid |
| smile | O(CC)[C@@H](C(=O)O)CC1C=CC(=CC=1)OCC#CCOC1C=CC(=CC=1)C[C@H](C(=O)O)OCC |
| weight | 471 |
| scaffold ID | 600 |
| scaffold smile | C(#CCOc1ccccc1)COc1ccccc1 |
Ligand Activities
| NR Protein | Protein Name | Ligand ID | Ligand Name | EC 50 |
|---|---|---|---|---|
| NR1C1 | Peroxisome proliferator activated receptor alpha | 4941 | (2R)-3-[4-[(E)-5-[4-[(E)-5-[4-[(2R)-2-carboxy-2-ethoxyethyl]phenoxy]pent-3-en-1-ynyl]phenyl]pent-2-en-4-ynoxy]phenyl]-2-ethoxypropanoic acid | 0.7 |
Scaffold Activities Statistic