(E)-N-(4-chlorophenyl)sulfanyl-2,2,2-trifluoro-1-phenylethanimine

Formula:C14H9NClF3S Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-N-(4-chlorophenyl)sulfanyl-2,2,2-trifluoro-1-phenylethanimine is a drug-like molecule.

MolName(E)-N-(4-chlorophenyl)sulfanyl-2,2,2-trifluoro-1-phenylethanimine
MolecularFormulaC14H9NClF3S
SmilesFC(/C(/c1ccccc1)=N/Sc(cc1)ccc1Cl)(F)F
InChIInChI=1S/C14H9ClF3NS/c15-11-6-8-12(9-7-11)20-19-13(14(16,17)18)10-4-2-1-3-5-10/h1-9H
InChIKMLKGGMYFJMQESH-UHFFFAOYSA-N
TotalMolweight315.745
Molweight315.745
MonoisotopicMass315.00963
CLogP4.7647
CLogS-6.293
H Acceptors1
TotalSurfaceArea218.36
Relative PSA0.13281
PolarSurfaceArea37.66
Druglikeness-10.037
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.6
Fragments1
Non HAtoms20
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms6
BasicNitrogens1
StereoCon

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