Molecule Details
| InChIKey | QZNGFWQWWSECMG-HUUCEWRRSA-N |
|---|---|
| Canonical SMILES | O=C(NC1CCOCC1)c1csc([C@@H]2C[C@H]2NCC2CC2)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.51 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB16939 |
|---|---|
| Drug Name | TAK-418 free base |
| CAS Number | 1818252-52-6 |
| Groups | investigational |
| ATC Codes | nan |
| Description | nan |
Categories: Sulfur Compounds
Cross-references: BindingDB: 50153586 CHEMBL3775474 ChemSpider: 58917447 ZINC: ZINC000653743780