4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]butanamide

Formula:C22H19N3O2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high 4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]butanamide is not a drug-like molecule.

MolName	4-(2,4-dichlorophenoxy)-N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]butanamide
MolecularFormula	C22H19N3O2Cl2
Smiles	O=C(CCCOc(ccc(Cl)c1)c1Cl)N/N=C(\c1ccccc1)/c1ccncc1
InChI	InChI=1S/C22H19Cl2N3O2/c23-18-8-9-20(19(24)15-18)29-14-4-7-21(28)26-27-22(16-5-2-1-3-6-16)17-10-12-25-13-11-17/h1-3,5-6,8-13,15H,4,7,14H2,(H,26,28)
InChIK	NJIQWPLMYUGLJU-UHFFFAOYSA-N
TotalMolweight	428.318
Molweight	428.318
MonoisotopicMass	427.085431
CLogP	5.0931
CLogS	-6.494
H Acceptors	5
H Donors	1
TotalSurfaceArea	325.84
Relative PSA	0.17487
PolarSurfaceArea	63.58
Druglikeness	-0.87543
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	high
Nasty Functions	acyl-hydrazone
Shape Index	0.58621
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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