Molecule Details
| InChIKey | VLFDPMJDVIHWPI-ROUUACIJSA-N |
|---|---|
| Compound Name | (4S)-5-amino-4-[[(2S)-4-carboxy-2-[3-[4-(4-methylthiophen-2-yl)phenyl]propanoylamino]butanoyl]amino]-5-oxopentanoic acid |
| Canonical SMILES | Cc1csc(-c2ccc(CCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(N)=O)cc2)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.78 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile