Molecule Details
| InChIKey | MMCXQRSWIBICHB-PHANLHFBSA-N |
|---|---|
| Compound Name | (2S)-2-amino-N-[(4S,10R,15R,21S)-15-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4,21-dibenzyl-3,6,9,16,19,22-hexaoxo-1,2,5,8,17,20-hexazacyclodocos-12-en-10-yl]-3-(4-hydroxyphenyl)propanamide |
| Canonical SMILES | N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CC=CC[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@@H](Cc2ccccc2)C(=O)NNC(=O)[C@H](Cc2ccccc2)NC(=O)CNC1=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.22 |
| Source | BindingDB |
2D Structure
Activity Profile