2396 : (2R)-3-(4-{[(2E)-5-{4-[(3E)-5-{4-[(2R)-2-carboxy-2-ethoxyethyl]phenoxy}-3-methylpent-3-en-1-yn-1-yl]phenyl}-3-methylpent-2-en-4-yn-1-yl]oxy}phenyl)-2-ethoxypropanoic acid
Ligand Basic Message
| Ligand | Scaffold |
|---|---|
 |  |
| ID | 2396 |
| Name | (2R)-3-(4-{[(2E)-5-{4-[(3E)-5-{4-[(2R)-2-carboxy-2-ethoxyethyl]phenoxy}-3-methylpent-3-en-1-yn-1-yl]phenyl}-3-methylpent-2-en-4-yn-1-yl]oxy}phenyl)-2-ethoxypropanoic acid |
| smile | CCO[C@@H](C(O)=O)CC1=CC=C(C=C1)OC/C=C(/C#CC1=CC=C(C#C/C(/C)=C/COC2=CC=C(C=C2)C[C@H](C(O)=O)OCC)C=C1)\C |
| weight | 651 |
| scaffold ID | 592 |
| scaffold smile | C(#Cc1ccc(C#CC=CCOc2ccccc2)cc1)C=CCOc1ccccc1 |
Ligand Activities
| NR Protein | Protein Name | Ligand ID | Ligand Name | EC 50 |
|---|---|---|---|---|
| NR1C2 | Peroxisome proliferator activated receptor delta | 2396 | (2R)-3-(4-{[(2E)-5-{4-[(3E)-5-{4-[(2R)-2-carboxy-2-ethoxyethyl]phenoxy}-3-methylpent-3-en-1-yn-1-yl]phenyl}-3-methylpent-2-en-4-yn-1-yl]oxy}phenyl)-2-ethoxypropanoic acid | 1.8 |
Scaffold Activities Statistic