[4-bromo-2-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate

Formula:C28H20N2O4BrCl Mutagenic:high Tumorigenic:none Reproductive Effective:none [4-bromo-2-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-(4-phenylphenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate
MolecularFormula	C28H20N2O4BrCl
Smiles	O=C(COc(cc1)ccc1-c1ccccc1)N/N=C\c(cc(cc1)Br)c1OC(c(cc1)ccc1Cl)=O
InChI	InChI=1S/C28H20BrClN2O4/c29-23-10-15-26(36-28(34)21-6-11-24(30)12-7-21)22(16-23)17-31-32-27(33)18-35-25-13-8-20(9-14-25)19-4-2-1-3-5-19/h1-17H,18H2,(H,32,33)
InChIK	GHBRJNYEGIVGTN-UHFFFAOYSA-N
TotalMolweight	563.834
Molweight	563.834
MonoisotopicMass	562.029496
CLogP	7.1974
CLogS	-8.627
H Acceptors	6
H Donors	1
TotalSurfaceArea	392.07
Relative PSA	0.17612
PolarSurfaceArea	76.99
Druglikeness	2.2306
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.63889
Fragments	1
Non HAtoms	36
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	3
Symmetricatoms	6
StereoCon

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