N-[(E)-3-anilino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]-2,4-dichlorobenzamide

Formula:C22H16N2O3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(E)-3-anilino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]-2,4-dichlorobenzamide is not a drug-like molecule.

MolName	N-[(E)-3-anilino-1-(4-hydroxyphenyl)-3-oxoprop-1-en-2-yl]-2,4-dichlorobenzamide
MolecularFormula	C22H16N2O3Cl2
Smiles	Oc1ccc(/C=C(\C(Nc2ccccc2)=O)/NC(c(ccc(Cl)c2)c2Cl)=O)cc1
InChI	InChI=1S/C22H16Cl2N2O3/c23-15-8-11-18(19(24)13-15)21(28)26-20(12-14-6-9-17(27)10-7-14)22(29)25-16-4-2-1-3-5-16/h1-13,27H,(H,25,29)(H,26,28)
InChIK	DGPQCLFNRCJQGN-UHFFFAOYSA-N
TotalMolweight	427.286
Molweight	427.286
MonoisotopicMass	426.053797
CLogP	5.2901
CLogS	-6.049
H Acceptors	5
H Donors	3
TotalSurfaceArea	313.1
Relative PSA	0.19834
PolarSurfaceArea	78.43
Druglikeness	3.0434
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Symmetricatoms	4
Amides	2
StereoCon

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