Molecule Details
| InChIKey | ARYOXIIIKMNCBV-PSTIANMPSA-N |
|---|---|
| Compound Name | N-[(4R,4aS,7S,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]-4-(1H-indol-3-yl)butanamide |
| Canonical SMILES | O=C(CCCc1c[nH]c2ccccc12)N[C@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5c4[C@@]2(CCN3CC2CC2)[C@H]1O5 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 9.18 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile