Molecule Details
| InChIKey | YENLCWWOFXIPIH-QOAPGFADSA-N |
|---|---|
| Compound Name | (S)-2-{(S)-3-Carboxy-2-[(2S,5S)-5-[3-(1-ethyl-propyl)-ureido]-6,6-dimethyl-4-oxo-2-(2-oxo-2-pyrrolidin-1-yl-ethyl)-heptanoylamino]-propionylamino}-4-methyl-pentanoic acid |
| Canonical SMILES | CCC(CC)NC(=O)N[C@H](C(=O)C[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)(C)C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.15 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile