Molecule Details
| InChIKey | FORMHTPKYXAYSB-SPHURBIESA-N |
|---|---|
| Compound Name | (2S,4S)-N-[(1S)-2-(benzylamino)-2-oxo-1-propan-2-ylsulfanylethyl]-4-hydroxy-4-[(13S)-18-[methyl(methylsulfonyl)amino]-2,15-dioxo-4-phenyl-11-oxa-3,14-diazatricyclo[14.3.1.15,9]henicosa-1(19),5,7,9(21),16(20),17-hexaen-13-yl]-2-propan-2-ylbutanamide |
| Canonical SMILES | CC(C)S[C@H](NC(=O)[C@@H](C[C@H](O)[C@@H]1COCc2cccc(c2)C(c2ccccc2)NC(=O)c2cc(cc(N(C)S(C)(=O)=O)c2)C(=O)N1)C(C)C)C(=O)NCc1ccccc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.02 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile