(E)-3-(4-bromophenyl)-N-[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine

Formula:C22H14N2OBrF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-bromophenyl)-N-[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine is not a drug-like molecule.

MolName	(E)-3-(4-bromophenyl)-N-[2-(3-fluorophenyl)-1,3-benzoxazol-5-yl]prop-2-en-1-imine
MolecularFormula	C22H14N2OBrF
Smiles	Fc1cccc(-c2nc(cc(cc3)/N=C/C=C/c(cc4)ccc4Br)c3o2)c1
InChI	InChI=1S/C22H14BrFN2O/c23-17-8-6-15(7-9-17)3-2-12-25-19-10-11-21-20(14-19)26-22(27-21)16-4-1-5-18(24)13-16/h1-14H
InChIK	FAKWBSZOAXLBFZ-UHFFFAOYSA-N
TotalMolweight	421.268
Molweight	421.268
MonoisotopicMass	420.027352
CLogP	5.5325
CLogS	-7.588
H Acceptors	3
TotalSurfaceArea	292.07
Relative PSA	0.12528
PolarSurfaceArea	38.39
Druglikeness	-3.1252
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	27
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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