Molecule Details
| InChIKey | NMPRQNFXEIFZOU-PNOMZVSUSA-N |
|---|---|
| Compound Name | methyl (2S)-2-[[(E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoyl]amino]-3-(1H-indol-3-yl)propanoate |
| Canonical SMILES | COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CC/C(C)=C/Cc1c(O)c2c(c(C)c1OC)COC2=O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.3 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile