4954 : 2-[4-[2-[4-cyclohexylbutyl-[(4-methyl-3-nitrophenyl)carbamoyl]amino]ethyl]phenyl]sulfanyl-2-methylpropanoic acid
Ligand Basic Message
| Ligand | Scaffold |
|---|---|
 |  |
| ID | 4954 |
| Name | 2-[4-[2-[4-cyclohexylbutyl-[(4-methyl-3-nitrophenyl)carbamoyl]amino]ethyl]phenyl]sulfanyl-2-methylpropanoic acid |
| smile | S(C(C(=O)O)(C)C)C1C=CC(=CC=1)CCN(C(NC1C=CC(C)=C(C=1)[N+](=O)[O-])=O)CCCCC1CCCCC1 |
| weight | 556 |
| scaffold ID | 831 |
| scaffold smile | O=C(Nc1ccccc1)N(CCCCC1CCCCC1)CCc1ccccc1 |
Ligand Activities
| NR Protein | Protein Name | Ligand ID | Ligand Name | EC 50 |
|---|---|---|---|---|
| NR1C1 | Peroxisome proliferator activated receptor alpha | 4954 | 2-[4-[2-[4-cyclohexylbutyl-[(4-methyl-3-nitrophenyl)carbamoyl]amino]ethyl]phenyl]sulfanyl-2-methylpropanoic acid | 0.02 |
Scaffold Activities Statistic