Molecule Details
| InChIKey | NYSRSUOUMRCIKK-UVRMNOBXSA-N |
|---|---|
| Compound Name | (S)-25-Amino-13-(4-amino-butyl)-7,22-dibenzyl-10-((S)-1-hydroxy-ethyl)-16-(1H-indol-3-ylmethyl)-19-methyl-6,9,12,15,18-penta(S)-oxo-21-(R)-oxo-24-oxo-1,2-dithia-5,8,11,14,17,20,23-heptaaza-cyclohexacosane-4-carboxylic acid |
| Canonical SMILES | C[C@@H]1NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@H](N)CSSC[C@@H](C(=O)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.87 |
| Source | BindingDB |
2D Structure
Activity Profile