Molecule Details
| InChIKey | KTMGUHOUDWBEQT-PCMUPDFDSA-N |
|---|---|
| Compound Name | (S)-4-Acetylamino-4-[(S)-1-((S)-1-{(S)-1-[(2S,4R)-4-benzyloxy-2-((S)-1-formyl-propylcarbamoyl)-pyrrolidine-1-carbonyl]-2-methyl-propylcarbamoyl}-2-methyl-propylcarbamoyl)-2-carboxy-ethylcarbamoyl]-butyric acid |
| Canonical SMILES | CC[C@@H](C=O)NC(=O)[C@@H]1C[C@@H](OCc2ccccc2)CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(C)=O)C(C)C)C(C)C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.05 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile