(NZ)-N-[(2-phenylsulfanylpyridin-3-yl)methylidene]hydroxylamine
Formula:C12H10N2OS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(2-phenylsulfanylpyridin-3-yl)methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[(2-phenylsulfanylpyridin-3-yl)methylidene]hydroxylamine |
| MolecularFormula | C12H10N2OS |
| Smiles | O/N=C\c1cccnc1Sc1ccccc1 |
| InChI | InChI=1S/C12H10N2OS/c15-14-9-10-5-4-8-13-12(10)16-11-6-2-1-3-7-11/h1-9,15H |
| InChIK | ZYCVBIWMCZHAQF-UHFFFAOYSA-N |
| TotalMolweight | 230.29 |
| Molweight | 230.29 |
| MonoisotopicMass | 230.051383 |
| CLogP | 3.1319 |
| CLogS | -3.069 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 180.38 |
| Relative PSA | 0.29421 |
| PolarSurfaceArea | 70.78 |
| Druglikeness | -0.36659 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 16 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (NZ)-N-[(2-phenylsulfanylpyridin-3-yl)methylidene]hydroxylamine | 2 - (NZ)-N-[(2-phenylsulfanylpyridin-3-yl)methylidene]hydroxylamine
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