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

Formula:C22H15N2O4BrCl2 Mutagenic:high Tumorigenic:none Reproductive Effective:high [4-bromo-2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate
MolecularFormula	C22H15N2O4BrCl2
Smiles	O=C(COc(cc1)ccc1Cl)N/N=C\c(cc(cc1)Br)c1OC(c(cccc1)c1Cl)=O
InChI	InChI=1S/C22H15BrCl2N2O4/c23-15-5-10-20(31-22(29)18-3-1-2-4-19(18)25)14(11-15)12-26-27-21(28)13-30-17-8-6-16(24)7-9-17/h1-12H,13H2,(H,27,28)
InChIK	BHGQCPTUMIDKJJ-UHFFFAOYSA-N
TotalMolweight	522.181
Molweight	522.181
MonoisotopicMass	519.959223
CLogP	6.1442
CLogS	-7.277
H Acceptors	6
H Donors	1
TotalSurfaceArea	347.73
Relative PSA	0.19857
PolarSurfaceArea	76.99
Druglikeness	2.2306
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.6129
Fragments	1
Non HAtoms	31
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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1 - [4-bromo-2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate | 2 - [4-bromo-2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate

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