[2,4-dibromo-6-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate

Formula:C23H14N2O6Br2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high [2,4-dibromo-6-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate is not a drug-like molecule.

MolName	[2,4-dibromo-6-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate
MolecularFormula	C23H14N2O6Br2Cl2
Smiles	O=C(COc(ccc(Cl)c1)c1Cl)N/N=C\c1cc(Br)cc(Br)c1OC(c(cc1)cc2c1OCO2)=O
InChI	InChI=1S/C23H14Br2Cl2N2O6/c24-14-5-13(9-28-29-21(30)10-32-18-4-2-15(26)8-17(18)27)22(16(25)7-14)35-23(31)12-1-3-19-20(6-12)34-11-33-19/h1-9H,10-11H2,(H,29,30)
InChIK	NLQWWTZGHYPHGN-UHFFFAOYSA-N
TotalMolweight	645.086
Molweight	645.086
MonoisotopicMass	641.859564
CLogP	6.9808
CLogS	-8.822
H Acceptors	8
H Donors	1
TotalSurfaceArea	386.62
Relative PSA	0.23033
PolarSurfaceArea	95.45
Druglikeness	2.2014
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.57143
Fragments	1
Non HAtoms	35
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	6
StereoCon

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1 - [2,4-dibromo-6-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate | 2 - [2,4-dibromo-6-[(Z)-[[2-(2,4-dichlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate

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