Molecule Details
| InChIKey | CPQPWWQOZGDNGK-QVDUQQMDSA-N |
|---|---|
| Compound Name | N-[(4R,4aS,7aR,12bR)-3-(cyclopropylmethyl)-9-hydroxy-7-oxo-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-4a-yl]-4-(4-chlorophenyl)butanamide |
| Canonical SMILES | O=C(CCCc1ccc(Cl)cc1)N[C@@]12CCC(=O)[C@@H]3Oc4c(O)ccc5c4[C@@]31CCN(CC1CC1)[C@@H]2C5 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.83 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile