[4-bromo-2-[(Z)-[[2-(2,4,6-tribromophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate

Formula:C22H13N2O4Br5 Mutagenic:high Tumorigenic:none Reproductive Effective:high [4-bromo-2-[(Z)-[[2-(2,4,6-tribromophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[[2-(2,4,6-tribromophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-bromobenzoate
MolecularFormula	C22H13N2O4Br5
Smiles	O=C(COc(c(Br)cc(Br)c1)c1Br)N/N=C\c(cc(cc1)Br)c1OC(c(cc1)ccc1Br)=O
InChI	InChI=1S/C22H13Br5N2O4/c23-14-3-1-12(2-4-14)22(31)33-19-6-5-15(24)7-13(19)10-28-29-20(30)11-32-21-17(26)8-16(25)9-18(21)27/h1-10H,11H2,(H,29,30)
InChIK	IUMXFZWJHSRCCE-UHFFFAOYSA-N
TotalMolweight	768.875
Molweight	768.875
MonoisotopicMass	763.679213
CLogP	7.833
CLogS	-9.141
H Acceptors	6
H Donors	1
TotalSurfaceArea	391.41
Relative PSA	0.17641
PolarSurfaceArea	76.99
Druglikeness	2.1789
Mutagenic	high
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; polyhalo aromatic ring
Shape Index	0.60606
Fragments	1
Non HAtoms	33
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	5
StereoCon

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