Molecule Details
| InChIKey | GGHQSOZWTNKBHK-GRKSIORSSA-N |
|---|---|
| Compound Name | cyclo[2Nal-Pro-Pro-Ile-Cys(1)-Phe-Pro-Asp-Gly-Arg-Cys(1)-Thr-Lys-Ser] |
| Canonical SMILES | CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N2 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.32 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile