(NZ)-N-[(2,4-dichloro-1,3-thiazol-5-yl)methylidene]hydroxylamine
Formula:C4H2N2OCl2S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(2,4-dichloro-1,3-thiazol-5-yl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(2,4-dichloro-1,3-thiazol-5-yl)methylidene]hydroxylamine |
| MolecularFormula | C4H2N2OCl2S |
| Smiles | O/N=C\c(sc(Cl)n1)c1Cl |
| InChI | InChI=1S/C4H2Cl2N2OS/c5-3-2(1-7-9)10-4(6)8-3/h1,9H |
| InChIK | JSJDEBDHPLBYEN-UHFFFAOYSA-N |
| TotalMolweight | 197.045 |
| Molweight | 197.045 |
| MonoisotopicMass | 195.926487 |
| CLogP | 2.9307 |
| CLogS | -3.262 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 129.91 |
| Relative PSA | 0.43061 |
| PolarSurfaceArea | 73.72 |
| Druglikeness | 1.6255 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3Atoms | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (NZ)-N-[(2,4-dichloro-1,3-thiazol-5-yl)methylidene]hydroxylamine | 2 - (NZ)-N-[(2,4-dichloro-1,3-thiazol-5-yl)methylidene]hydroxylamine
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