Molecule Details
| InChIKey | PKBSRAAKQRNSBG-WXUCUDSSSA-N |
|---|---|
| Compound Name | Jizanpeptin D |
| Canonical SMILES | CC[C@@H](C)[C@H]1C(=O)N(C)[C@@H](Cc2ccc(OC)c(Br)c2)C(=O)N[C@@H]([C@@H](C)CC)C(=O)O[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](COS(=O)(=O)O)OC)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]2CC[C@@H](O)N1C2=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.0 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile