N-[(E)-1-(4-chlorophenyl)-3-oxo-3-(2-phenylethylamino)prop-1-en-2-yl]benzamide

Formula:C24H21N2O2Cl Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-1-(4-chlorophenyl)-3-oxo-3-(2-phenylethylamino)prop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(E)-1-(4-chlorophenyl)-3-oxo-3-(2-phenylethylamino)prop-1-en-2-yl]benzamide
MolecularFormula	C24H21N2O2Cl
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\c(cc1)ccc1Cl)NCCc1ccccc1
InChI	InChI=1S/C24H21ClN2O2/c25-21-13-11-19(12-14-21)17-22(27-23(28)20-9-5-2-6-10-20)24(29)26-16-15-18-7-3-1-4-8-18/h1-14,17H,15-16H2,(H,26,29)(H,27,28)
InChIK	OBELUSOQRGZZRM-UHFFFAOYSA-N
TotalMolweight	404.896
Molweight	404.896
MonoisotopicMass	404.129155
CLogP	5.1693
CLogS	-5.537
H Acceptors	4
H Donors	2
TotalSurfaceArea	318.85
Relative PSA	0.15368
PolarSurfaceArea	58.2
Druglikeness	3.5541
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	6
Amides	2
StereoCon

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