Molecule Details
| InChIKey | HKGUEYWZKLSNKN-KWXIBIRDSA-N |
|---|---|
| Compound Name | (2S,4R)-2-butyl-6-[4-(4-cyanophenyl)phenyl]-4-[[(2S)-3,3-dimethyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]hexanoic acid |
| Canonical SMILES | CCCC[C@@H](C[C@@H](CCc1ccc(-c2ccc(C#N)cc2)cc1)C(=O)N[C@H](C(=O)NC)C(C)(C)C)C(=O)O |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.92 |
| Source | ChEMBL;BindingDB;TTD_MultiTarget |
2D Structure
Activity Profile