Molecule Details
| InChIKey | DOTLHOVQYVFUDB-YKSBVNFPSA-N |
|---|---|
| Compound Name | (2R,3S)-5-[3-[[5-(2-methoxy-3-pyridinyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propyl]-2-[4-(trifluoromethyl)phenyl]-5-azaspiro[2.4]heptane |
| Canonical SMILES | COc1ncccc1-c1nnc(SCCCN2CC[C@]3(C[C@@H]3c3ccc(C(F)(F)F)cc3)C2)n1C |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.4 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile