(Z)-1-[3-(1,3-dioxolan-2-yl)pyridin-2-yl]-N-phenylmethoxymethanimine
Molecular Formula : C16H16N2O3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |(Z)-1-[3-(1,3-dioxolan-2-yl)pyridin-2-yl]-N-phenylmethoxymethanimine is a drug-like molecule.
MolName : (Z)-1-[3-(1,3-dioxolan-2-yl)pyridin-2-yl]-N-phenylmethoxymethanimine |
MolecularFormula : C16H16N2O3 |
Smiles : C(c1ccccc1)O/N=C\c1c(C2OCCO2)cccn1 |
InChI : InChI=1S/C16H16N2O3/c1-2-5-13(6-3-1)12-21-18-11-15-14(7-4-8-17-15)16-19-9-10-20-16/h1-8,11,16H,9-10,12H2 |
InChIK : LLFWRPKMXCBPGE-UHFFFAOYSA-N |
TotalMolweight : 284.314 |
Molweight : 284.314 |
MonoisotopicMass : 284.116093 |
CLogP : 2.2445 |
CLogS : -2.838 |
H Acceptors : 5 |
TotalSurfaceArea : 226.82 |
Relative PSA : 0.23137 |
PolarSurfaceArea : 52.94 |
Druglikeness : -5.7523 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.61905 |
Fragments : 1 |
Non HAtoms : 21 |
NonCHAtoms : 5 |
Electronegative Atoms : 5 |
Rotatable Bond : 5 |
Rings Closures : 3 |
Small Rings : 3 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Sp3Atoms : 7 |
Symmetricatoms : 4 |
Aromatic Nitrogens : 1 |
StereoCon : |