[4-bromo-2-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate

Formula:C22H16N2O4BrF Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-bromo-2-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate
MolecularFormula	C22H16N2O4BrF
Smiles	O=C(COc(cc1)ccc1F)N/N=C\c(cc(cc1)Br)c1OC(c1ccccc1)=O
InChI	InChI=1S/C22H16BrFN2O4/c23-17-6-11-20(30-22(28)15-4-2-1-3-5-15)16(12-17)13-25-26-21(27)14-29-19-9-7-18(24)8-10-19/h1-13H,14H2,(H,26,27)
InChIK	SESNJLOHVMVQIR-UHFFFAOYSA-N
TotalMolweight	471.281
Molweight	471.281
MonoisotopicMass	470.027747
CLogP	5.033
CLogS	-6.119
H Acceptors	6
H Donors	1
TotalSurfaceArea	323.24
Relative PSA	0.21362
PolarSurfaceArea	76.99
Druglikeness	0.83891
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.63333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	4
StereoCon

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