Molecule Details
| InChIKey | RDYCCDUYPPTUMP-WDEDYMKJSA-N |
|---|---|
| Compound Name | (S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Benzyl-3-phenyl-propionylamino)-3-methyl-butyrylamino]-3-methyl-butyrylamino}-3-carbamoyl-propionylamino)-3-carboxy-propionylamino]-4-methyl-pentanoic acid |
| Canonical SMILES | CC(C)C[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C(Cc1ccccc1)Cc1ccccc1)C(C)C)C(C)C)C(=O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.75 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile