(3Z)-1-(4-chlorophenyl)-3-[(3,4-dichlorophenyl)methoxyimino]propan-1-one
Molecular Formula : C16H12NO2Cl3 | Mutagenic : none | Tumorigenic : none | Reproductive Effective : none |(3Z)-1-(4-chlorophenyl)-3-[(3,4-dichlorophenyl)methoxyimino]propan-1-one is a drug-like molecule.
MolName : (3Z)-1-(4-chlorophenyl)-3-[(3,4-dichlorophenyl)methoxyimino]propan-1-one |
MolecularFormula : C16H12NO2Cl3 |
Smiles : O=C(C/C=N\OCc(cc1)cc(Cl)c1Cl)c(cc1)ccc1Cl |
InChI : InChI=1S/C16H12Cl3NO2/c17-13-4-2-12(3-5-13)16(21)7-8-20-22-10-11-1-6-14(18)15(19)9-11/h1-6,8-9H,7,10H2 |
InChIK : LTFGJHUOYHOJIX-UHFFFAOYSA-N |
TotalMolweight : 356.635 |
Molweight : 356.635 |
MonoisotopicMass : 354.99336 |
CLogP : 4.907 |
CLogS : -6.188 |
H Acceptors : 3 |
TotalSurfaceArea : 259.31 |
Relative PSA : 0.13324 |
PolarSurfaceArea : 38.66 |
Druglikeness : 0.97067 |
Mutagenic : none |
Tumorigenic : none |
Reproductive Effective : none |
Irritant : none |
Nasty Functions : |
Shape Index : 0.72727 |
Fragments : 1 |
Non HAtoms : 22 |
NonCHAtoms : 6 |
Electronegative Atoms : 6 |
Rotatable Bond : 6 |
Rings Closures : 2 |
Small Rings : 2 |
Aromatic Rings : 2 |
Aromatic Atoms : 12 |
Sp3Atoms : 3 |
Symmetricatoms : 2 |
StereoCon : |