Chemical Name - 6-Methyl Thiouracil
Mol Weight - 142.182
Smiles - CC(NC(N1)=S)=CC1=O
Mol Weight - 142.182
Smiles - CC(NC(N1)=S)=CC1=O
| Property Value | |
| Mol Name | 6-Methyl Thiouracil |
| Molweight | 142.182 |
| Monoisotopic Mass | 142.020083 |
| Clogp | -0.0116 |
| Clogs | -1.592 |
| H Acceptors | 3 |
| H Donors | 2 |
| Total Surface Area | 110.35 |
| Relative Psa | 0.57961 |
| Polar Surface Area | 73.22 |
| Druglikeness | -1.8085 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Shape Index | 0.55556 |
| Molecular Flexibility | 0.10562 |
| Molecular Complexity | 0.72259 |
| Fragments | 1 |
| Non H Atoms | 9 |
| Non Ch Atoms | 4 |
| Electronegative Atoms | 4 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 2 |
| Amides | 1 |
| Smiles | CC(NC(N1)=S)=CC1=O |
| InChIKey | InChI=1S/C5H6N2OS/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9) |
| InChI | HWGBHCRJGXAGEU-UHFFFAOYSA-N |
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1 - 6-Methyl Thiouracil
2 - 6-Methyl Thiouracil
1 - 6-Methyl Thiouracil
2 - 6-Methyl Thiouracil
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