Molecule Details
| InChIKey | MERYTOPZZMIEFD-UCQJWODQSA-N |
|---|---|
| Compound Name | benzyl N-[(2S)-1-[(2S)-2-[[2,2-dimethyl-1-[(2S,6R)-2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.02,6]decan-4-yl]butyl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3,3-diphenylpropan-2-yl]carbamate |
| Canonical SMILES | CCC(C)(C)C(NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OCc1ccccc1)C(c1ccccc1)c1ccccc1)B1O[C@@H]2CC3CC(C3(C)C)[C@]2(C)O1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.43 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile