(E)-2-bromo-N-[(Z)-(2-bromo-1-phenylethylidene)amino]-1-phenylethanimine

Formula:C16H14N2Br2 Mutagenic:low Tumorigenic:high Reproductive Effective:high (E)-2-bromo-N-[(Z)-(2-bromo-1-phenylethylidene)amino]-1-phenylethanimine is not a drug-like molecule.

MolName(E)-2-bromo-N-[(Z)-(2-bromo-1-phenylethylidene)amino]-1-phenylethanimine
MolecularFormulaC16H14N2Br2
SmilesBrC/C(/c1ccccc1)=N\N=C(\CBr)/c1ccccc1
InChIInChI=1S/C16H14Br2N2/c17-11-15(13-7-3-1-4-8-13)19-20-16(12-18)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKOKSVKMYYVXABJN-UHFFFAOYSA-N
TotalMolweight394.109
Molweight394.109
MonoisotopicMass391.95237
CLogP5.382
CLogS-5.938
H Acceptors2
TotalSurfaceArea243.74
Relative PSA0.094445
PolarSurfaceArea24.72
Druglikeness-5.1192
Mutageniclow
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functionsprim. alkyl-bromide/iodide; dimethylene-hydrazine
Shape Index0.6
Fragments1
Non HAtoms20
NonCHAtoms4
Electronegative Atoms4
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms4
StereoCon

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