Molecule Details
| InChIKey | QELDYWYCXPWQIN-NQEYMWBOSA-N |
|---|---|
| Compound Name | L-Threoninamide,3-(2-naphthalenyl)-D-alanyl-4-chloro-L-phenylalanyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-threonyl-L-phenylalanyl-(9CI) |
| Canonical SMILES | CC(O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)C(Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(Cl)cc1)NC(=O)[C@H](N)Cc1ccc2ccccc2c1)C(C)O)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@H](C(N)=O)[C@@H](C)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.67 |
| Source | BindingDB |
2D Structure
Activity Profile