[4-[(Z)-[[2-(4-bromophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate

Formula:C22H16N2O4BrF Mutagenic:low Tumorigenic:none Reproductive Effective:none [4-[(Z)-[[2-(4-bromophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate is not a drug-like molecule.

MolName	[4-[(Z)-[[2-(4-bromophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-fluorobenzoate
MolecularFormula	C22H16N2O4BrF
Smiles	O=C(COc(cc1)ccc1Br)N/N=C\c(cc1)ccc1OC(c(cccc1)c1F)=O
InChI	InChI=1S/C22H16BrFN2O4/c23-16-7-11-17(12-8-16)29-14-21(27)26-25-13-15-5-9-18(10-6-15)30-22(28)19-3-1-2-4-20(19)24/h1-13H,14H2,(H,26,27)
InChIK	AVQQNVBVPUZTNO-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	low
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.7
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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