Molecule Details
| InChIKey | KOOHGEPKDRNWTM-FQEVSTJZSA-N |
|---|---|
| Compound Name | (S)-2-(3-(6-(4-methyl-4H-1,2,4-triazol-3-yl)-2-oxaspiro[3.3]heptan-6-yl)phenyl)-6-((3-methylpiperidin-1-yl)methyl)-4-(trifluoromethyl)isoindolin-1-one |
| Canonical SMILES | C[C@H]1CCCN(Cc2cc3c(c(C(F)(F)F)c2)CN(c2cccc(C4(c5nncn5C)CC5(COC5)C4)c2)C3=O)C1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.43 |
| Source | BindingDB |
2D Structure
Activity Profile