Chemical Name - Ethylenethiourea
Mol Weight - 102.161
Smiles - S=C1NCCN1
Mol Weight - 102.161
Smiles - S=C1NCCN1
| Property Value | |
| Mol Name | Ethylenethiourea |
| Molweight | 102.161 |
| Monoisotopic Mass | 102.025168 |
| Clogp | -0.189 |
| Clogs | -0.86 |
| H Acceptors | 2 |
| H Donors | 2 |
| Total Surface Area | 83.15 |
| Relative Psa | 0.61239 |
| Polar Surface Area | 56.15 |
| Druglikeness | 0.41759 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.66667 |
| Molecular Complexity | 0.59725 |
| Fragments | 1 |
| Non H Atoms | 6 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 3 |
| Symmetric Atoms | 2 |
| Smiles | S=C1NCCN1 |
| InChIKey | InChI=1S/C3H6N2S/c6-3-4-1-2-5-3/h1-2H2,(H2,4,5,6) |
| InChI | PDQAZBWRQCGBEV-UHFFFAOYSA-N |
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