(NZ)-N-[(2-chloro-1,3-thiazol-5-yl)methylidene]hydroxylamine
Formula:C4H3N2OClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(2-chloro-1,3-thiazol-5-yl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(2-chloro-1,3-thiazol-5-yl)methylidene]hydroxylamine |
| MolecularFormula | C4H3N2OClS |
| Smiles | O/N=C\c(s1)cnc1Cl |
| InChI | InChI=1S/C4H3ClN2OS/c5-4-6-1-3(9-4)2-7-8/h1-2,8H |
| InChIK | XRCSXPRUVFLEDY-UHFFFAOYSA-N |
| TotalMolweight | 162.6 |
| Molweight | 162.6 |
| MonoisotopicMass | 161.96546 |
| CLogP | 2.2273 |
| CLogS | -2.763 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 114.49 |
| Relative PSA | 0.4886 |
| PolarSurfaceArea | 73.72 |
| Druglikeness | 1.28 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.77778 |
| Fragments | 1 |
| Non HAtoms | 9 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| 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-chloro-1,3-thiazol-5-yl)methylidene]hydroxylamine | 2 - (NZ)-N-[(2-chloro-1,3-thiazol-5-yl)methylidene]hydroxylamine
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