(NZ)-N-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methylidene]hydroxylamine
Formula:C13H9N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methylidene]hydroxylamine is a drug-like molecule.
| MolName | (NZ)-N-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methylidene]hydroxylamine |
| MolecularFormula | C13H9N2O2F3 |
| Smiles | O/N=C\c(cc1)cnc1Oc1cccc(C(F)(F)F)c1 |
| InChI | InChI=1S/C13H9F3N2O2/c14-13(15,16)10-2-1-3-11(6-10)20-12-5-4-9(7-17-12)8-18-19/h1-8,19H |
| InChIK | AQRQZTWECSYTTL-UHFFFAOYSA-N |
| TotalMolweight | 282.22 |
| Molweight | 282.22 |
| MonoisotopicMass | 282.061612 |
| CLogP | 3.8087 |
| CLogS | -5.12 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 202.35 |
| Relative PSA | 0.22525 |
| PolarSurfaceArea | 54.71 |
| Druglikeness | -8.1842 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (NZ)-N-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methylidene]hydroxylamine | 2 - (NZ)-N-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]methylidene]hydroxylamine
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