[4-[(Z)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] 4-(2,4-dichlorophenoxy)butanoate

Formula:C23H19N3O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high [4-[(Z)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] 4-(2,4-dichlorophenoxy)butanoate is not a drug-like molecule.

MolName	[4-[(Z)-(pyridine-4-carbonylhydrazinylidene)methyl]phenyl] 4-(2,4-dichlorophenoxy)butanoate
MolecularFormula	C23H19N3O4Cl2
Smiles	O=C(CCCOc(ccc(Cl)c1)c1Cl)Oc1ccc(/C=N\NC(c2ccncc2)=O)cc1
InChI	InChI=1S/C23H19Cl2N3O4/c24-18-5-8-21(20(25)14-18)31-13-1-2-22(29)32-19-6-3-16(4-7-19)15-27-28-23(30)17-9-11-26-12-10-17/h3-12,14-15H,1-2,13H2,(H,28,30)
InChIK	PCWFFWACNBYGSE-UHFFFAOYSA-N
TotalMolweight	472.327
Molweight	472.327
MonoisotopicMass	471.075261
CLogP	5.3269
CLogS	-6.188
H Acceptors	7
H Donors	1
TotalSurfaceArea	355.38
Relative PSA	0.22517
PolarSurfaceArea	89.88
Druglikeness	-2.3813
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.71875
Fragments	1
Non HAtoms	32
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	10
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	5
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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