(NE)-N-(1,1-dioxothiolan-3-ylidene)hydroxylamine
Formula:C4H7NO3S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NE)-N-(1,1-dioxothiolan-3-ylidene)hydroxylamine is a drug-like molecule.
| MolName | (NE)-N-(1,1-dioxothiolan-3-ylidene)hydroxylamine |
| MolecularFormula | C4H7NO3S |
| Smiles | O/N=C(\CC1)/CS1(=O)=O |
| InChI | InChI=1S/C4H7NO3S/c6-5-4-1-2-9(7,8)3-4/h6H,1-3H2 |
| InChIK | DUTLZLJKFPZPQQ-UHFFFAOYSA-N |
| TotalMolweight | 149.17 |
| Molweight | 149.17 |
| MonoisotopicMass | 149.014664 |
| CLogP | -0.227 |
| CLogS | -1.147 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 99.18 |
| Relative PSA | 0.5363 |
| PolarSurfaceArea | 75.11 |
| Druglikeness | -4.1037 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 9 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3Atoms | 5 |
| Symmetricatoms | 1 |
| StereoCon |
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