(Z)-1-(1-chloro-3,4-dihydronaphthalen-2-yl)-N-[(4-fluorophenyl)methoxy]methanimine

Formula:C18H15NOClF Mutagenic:high Tumorigenic:none Reproductive Effective:high (Z)-1-(1-chloro-3,4-dihydronaphthalen-2-yl)-N-[(4-fluorophenyl)methoxy]methanimine is a drug-like molecule.

MolName(Z)-1-(1-chloro-3,4-dihydronaphthalen-2-yl)-N-[(4-fluorophenyl)methoxy]methanimine
MolecularFormulaC18H15NOClF
SmilesFc1ccc(CO/N=C\C(CCc2c3cccc2)=C3Cl)cc1
InChIInChI=1S/C18H15ClFNO/c19-18-15(8-7-14-3-1-2-4-17(14)18)11-21-22-12-13-5-9-16(20)10-6-13/h1-6,9-11H,7-8,12H2
InChIKFRQLUQOXNGOXFP-UHFFFAOYSA-N
TotalMolweight315.774
Molweight315.774
MonoisotopicMass315.082619
CLogP4.9045
CLogS-3.84
H Acceptors2
TotalSurfaceArea240.25
Relative PSA0.089532
PolarSurfaceArea21.59
Druglikeness-1.5046
Mutagenichigh
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionsallyl/benzyl chloride
Shape Index0.68182
Fragments1
Non HAtoms22
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms4
Symmetricatoms2
StereoCon

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