| General Information of Drug (ID:
DR1585) |
| Drug Name |
Thiram
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| Synonyms |
Arasan; Arasan-M; Atiram; Falitiram; Fermide; Fernasan; Fernasan A; Fernide; Formalsol; Hermal; Hexathir; Kregasan; Mercuram; Methyl Thiram; Methyl tuads; Nobecutan; Nocceler TT; Normersan; Polyram ultra; Pomarsol; Pomarsol forte; Pomasol; Puralin; Rezifilm; Sadoplon; Spotrete; Tersan; Tetramethylthiuram; Tetramethylthiuram disulfide; Tetrasipton; Tetrathiuram disulfide; Thillate; Thiotox; Thiram B; Thiramad; Thirame; Thirasan; Thiulin; Thiulix; Thiuram; thiram; 137-26-8; Aapirol; Aatiram; Accelerator T; Heryl; TMTD
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| Indication |
Discovery agent
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Investigative
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[1]
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| Structure |
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3D MOL
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2D MOL
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| Pharmaceutical Properties |
Molecular Weight |
240.4 |
Topological Polar Surface Area |
121 |
| Heavy Atom Count |
12 |
Rotatable Bond Count |
3 |
| Hydrogen Bond Donor Count |
0 |
Hydrogen Bond Acceptor Count |
4 |
| Cross-matching ID |
- PubChem CID
- 5455
- ChEBI ID
-
- CAS Number
-
- TTD Drug ID
- D02UVS
- Formula
- C6H12N2S4
- Canonical SMILES
- CN(C)C(=S)SSC(=S)N(C)C
- InChI
- 1S/C6H12N2S4/c1-7(2)5(9)11-12-6(10)8(3)4/h1-4H3
- InChIKey
- KUAZQDVKQLNFPE-UHFFFAOYSA-N
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| The Metabolic Roadmap of This Drug |
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| The Full List of Drug Metabolites (DM) of This Drug |
| DM Name |
DM ID |
PubChem ID |
Reaction |
DM Level |
REF |
|
CS2
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DM000120
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Unclear |
1 |
[3]
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| The Full List of Metabolic Reaction (MR) of This Drug |
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| Drug-Metabolizing Enzyme(s) (DME) Metabolizing This Drug |
| DME Name |
DME Info |
Species |
Uniprot ID |
EC Number |
REF |
|
Cytochrome P450 2E1 (CYP2E1)
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DME0013
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Homo sapiens
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[2]
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| References |
| 1 |
In silico identification and biochemical evaluation of novel inhibitors of NRH:quinone oxidoreductase 2 (NQO2). Bioorg Med Chem Lett. 2010 Dec 15;20(24):7331-6.
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| 2 |
Effect of cytochrome P450 inducers on the metabolism and toxicity of thiram in rats. Vet Hum Toxicol. 2002 Dec;44(6):331-3.
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| 3 |
Metabolism of a dithiocarbamate fungicide thiram to carbon disulfide in the rat and its hepatotoxic implications
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