Molecule Details
| InChIKey | WABPWGDKPXKISU-DOKIROKCSA-N |
|---|---|
| Compound Name | but-3-enyl N-[(2S)-1-[[1-[3-ethenyl-4-(6-methoxy-2-phenylpyrimidin-4-yl)oxyphenyl]-2-oxo-2-[[(2S)-1-oxo-1-(pent-4-enylsulfonylamino)pentan-2-yl]amino]ethyl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate |
| Canonical SMILES | C=CCCCS(=O)(=O)NC(=O)[C@H](CCC)NC(=O)C(NC(=O)[C@@H](NC(=O)OCCC=C)C(C)(C)C)c1ccc(Oc2cc(OC)nc(-c3ccccc3)n2)c(C=C)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.35 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile