N-[(Z)-3-(4-chloroanilino)-1-(2-chlorophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C22H16N2O2Cl2 Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-3-(4-chloroanilino)-1-(2-chlorophenyl)-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-3-(4-chloroanilino)-1-(2-chlorophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C22H16N2O2Cl2
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c(cccc1)c1Cl)Nc(cc1)ccc1Cl
InChI	InChI=1S/C22H16Cl2N2O2/c23-17-10-12-18(13-11-17)25-22(28)20(14-16-8-4-5-9-19(16)24)26-21(27)15-6-2-1-3-7-15/h1-14H,(H,25,28)(H,26,27)
InChIK	BFULMAQSQITCNH-UHFFFAOYSA-N
TotalMolweight	411.287
Molweight	411.287
MonoisotopicMass	410.058882
CLogP	5.6358
CLogS	-6.345
H Acceptors	4
H Donors	2
TotalSurfaceArea	306.75
Relative PSA	0.15974
PolarSurfaceArea	58.2
Druglikeness	3.0405
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Symmetricatoms	4
Amides	2
StereoCon

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