Molecule Details
| InChIKey | LMBWSYZSUOEYSN-UHFFFAOYSA-N |
|---|---|
| Compound Name | Diethyldithiocarbamic Acid |
| Canonical SMILES | CCN(CC)C(=S)S |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.24 |
| Source | ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB02520 |
|---|---|
| Drug Name | Ditiocarb |
| CAS Number | 147-84-2 |
| Groups | investigational |
| ATC Codes | nan |
| Description | A chelating agent that has been used to mobilize toxic metals from the tissues of man and experimental animals. It is the main metabolite of DISULFIRAM. |
Categories: Acids, Acyclic Adjuvants, Immunologic Anti-Infective Agents Carbamates Chelating Agents Compounds used in a research, industrial, or household setting Cytochrome P-450 CYP2E1 Inhibitors Cytochrome P-450 CYP2E1 Inhibitors (strength unknown) Cytochrome P-450 CYP3A Inhibitors Cytochrome P-450 CYP3A4 Inhibitors Cytochrome P-450 CYP3A4 Inhibitors (strong) Cytochrome P-450 CYP3A5 Inhibitors Cytochrome P-450 CYP3A5 Inhibitors (strength unknown) Cytochrome P-450 Enzyme Inhibitors Immunologic Factors Sequestering Agents Sulfur Compounds Thiocarbamates
Cross-references: BindingDB: 50428474 ChEBI: 144353 CHEMBL961 ChemSpider: 8639 C19150 PDB: DCD PubChem:8987 PubChem:46504708 RxCUI: 1427193 ZINC: ZINC000003633221