Molecule Details
| InChIKey | VMLJCXYBTLCGDU-FHYDSMICSA-N |
|---|---|
| Compound Name | 4-{(E)-3-[4-((3R,3aS)-7,8-Dimethoxy-3a,4-dihydro-3H-chromeno[4,3-c]isoxazol-3-ylmethyl)-piperazin-1-yl]-1-methyl-propenyl}-phenol |
| Canonical SMILES | COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C(\C)c4ccc(O)cc4)CC3)[C@@H]1CO2 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.69 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile