Molecule Details
| InChIKey | AQSNIXKAKUZPSI-SSTWWWIQSA-N |
|---|---|
| Compound Name | Stx-140 |
| Canonical SMILES | COc1cc2c(cc1OS(N)(=O)=O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](OS(N)(=O)=O)CC[C@@H]12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.84 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB08416 |
|---|---|
| Drug Name | (9BETA,13ALPHA,14BETA,17ALPHA)-2-METHOXYESTRA-1,3,5(10)-TRIENE-3,17-DIYL DISULFAMATE |
| CAS Number | nan |
| Groups | experimental |
| ATC Codes | nan |
| Description | nan |
Cross-references: BindingDB: 50200936 CHEMBL218382 ChemSpider: 7980062 PDB: PO1 PubChem:9804302 PubChem:99444887 ZINC: ZINC000003975451