(Z)-1-[2-[(2-fluorophenyl)methoxy]-3,5-diiodophenyl]-N-(1,2,4-triazol-4-yl)methanimine

Formula:C16H11N4OFI2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-1-[2-[(2-fluorophenyl)methoxy]-3,5-diiodophenyl]-N-(1,2,4-triazol-4-yl)methanimine is not a drug-like molecule.

MolName(Z)-1-[2-[(2-fluorophenyl)methoxy]-3,5-diiodophenyl]-N-(1,2,4-triazol-4-yl)methanimine
MolecularFormulaC16H11N4OFI2
SmilesFc1c(COc(c(/C=N\n2cnnc2)cc(I)c2)c2I)cccc1
InChIInChI=1S/C16H11FI2N4O/c17-14-4-2-1-3-11(14)8-24-16-12(5-13(18)6-15(16)19)7-22-23-9-20-21-10-23/h1-7,9-10H,8H2
InChIKGNFGVFHZXCVZOQ-UHFFFAOYSA-N
TotalMolweight548.088
Molweight548.088
MonoisotopicMass547.900635
CLogP3.5514
CLogS-7.997
H Acceptors5
TotalSurfaceArea286.93
Relative PSA0.17537
PolarSurfaceArea52.3
Druglikeness2.2175
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.54167
Fragments1
Non HAtoms24
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond5
Rings Closures3
Small Rings3
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
Symmetricatoms2
Aromatic Nitrogens3
StereoCon

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