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

Formula:C29H23N2O5Br Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-bromo-2-[(Z)-[[2-(4-phenylmethoxyphenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-(4-phenylmethoxyphenoxy)acetyl]hydrazinylidene]methyl]phenyl] benzoate
MolecularFormula	C29H23N2O5Br
Smiles	O=C(COc(cc1)ccc1OCc1ccccc1)N/N=C\c(cc(cc1)Br)c1OC(c1ccccc1)=O
InChI	InChI=1S/C29H23BrN2O5/c30-24-11-16-27(37-29(34)22-9-5-2-6-10-22)23(17-24)18-31-32-28(33)20-36-26-14-12-25(13-15-26)35-19-21-7-3-1-4-8-21/h1-18H,19-20H2,(H,32,33)
InChIK	LLAVVRKAKIKTSD-UHFFFAOYSA-N
TotalMolweight	559.415
Molweight	559.415
MonoisotopicMass	558.079034
CLogP	6.2803
CLogS	-7.146
H Acceptors	7
H Donors	1
TotalSurfaceArea	400.41
Relative PSA	0.19742
PolarSurfaceArea	86.22
Druglikeness	2.1789
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.64865
Fragments	1
Non HAtoms	37
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	11
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	5
Symmetricatoms	6
StereoCon

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