Chemical Name - Mercaptobenzothiazole Disulfide
Mol Weight - 231.388
Smiles - SC1=Nc(cccc2)c2S1(=S)=S
Mol Weight - 231.388
Smiles - SC1=Nc(cccc2)c2S1(=S)=S
| Property Value | |
| Mol Name | Mercaptobenzothiazole Disulfide |
| Molweight | 231.388 |
| Monoisotopic Mass | 230.930479 |
| Clogp | 3.2464 |
| Clogs | -4.668 |
| H Acceptors | 1 |
| Total Surface Area | 157.09 |
| Relative Psa | 0.5896 |
| Polar Surface Area | 123.72 |
| Druglikeness | -1.9808 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.5 |
| Molecular Complexity | 0.79792 |
| Fragments | 1 |
| Non H Atoms | 12 |
| Non Ch Atoms | 5 |
| Electronegative Atoms | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 4 |
| Symmetric Atoms | 1 |
| Smiles | SC1=Nc(cccc2)c2S1(=S)=S |
| InChIKey | InChI=1S/C7H5NS4/c9-7-8-5-3-1-2-4-6(5)12(7,10)11/h1-4H,(H,8,9) |
| InChI | KKDHWGOHWGLLPR-UHFFFAOYSA-N |
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1 - Mercaptobenzothiazole Disulfide
2 - Mercaptobenzothiazole Disulfide
1 - Mercaptobenzothiazole Disulfide
2 - Mercaptobenzothiazole Disulfide
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