Chemical Name - 4-Methyl ThiosemiCarbazide
Mol Weight - 105.165
Smiles - CNC(NN)=S
Mol Weight - 105.165
Smiles - CNC(NN)=S
| Property Value | |
| Mol Name | 4-Methyl ThiosemiCarbazide |
| Molweight | 105.165 |
| Monoisotopic Mass | 105.036067 |
| Clogp | -1.3353 |
| Clogs | -1.075 |
| H Acceptors | 3 |
| H Donors | 3 |
| Total Surface Area | 89.91 |
| Relative Psa | 0.73618 |
| Polar Surface Area | 82.17 |
| Druglikeness | -3.4839 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.83333 |
| Molecular Flexibility | 0.5837 |
| Molecular Complexity | 0.69315 |
| Fragments | 1 |
| Non H Atoms | 6 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Sp3 Atoms | 3 |
| Smiles | CNC(NN)=S |
| InChIKey | InChI=1S/C2H7N3S/c1-4-2(6)5-3/h3H2,1H3,(H2,4,5,6) |
| InChI | PTVZQOAHCSKAAS-UHFFFAOYSA-N |
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1 - 4-Methyl ThiosemiCarbazide
2 - 4-Methyl ThiosemiCarbazide
1 - 4-Methyl ThiosemiCarbazide
2 - 4-Methyl ThiosemiCarbazide
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