(E)-3-(3-chloroanilino)-1-(4-chlorophenyl)prop-2-en-1-one

Formula:C15H11NOCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(3-chloroanilino)-1-(4-chlorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(3-chloroanilino)-1-(4-chlorophenyl)prop-2-en-1-one
MolecularFormula	C15H11NOCl2
Smiles	O=C(/C=C/Nc1cccc(Cl)c1)c(cc1)ccc1Cl
InChI	InChI=1S/C15H11Cl2NO/c16-12-6-4-11(5-7-12)15(19)8-9-18-14-3-1-2-13(17)10-14/h1-10,18H
InChIK	PLJUWJNEEQFOML-UHFFFAOYSA-N
TotalMolweight	292.164
Molweight	292.164
MonoisotopicMass	291.021768
CLogP	3.6865
CLogS	-5.258
H Acceptors	2
H Donors	1
TotalSurfaceArea	219.57
Relative PSA	0.11158
PolarSurfaceArea	29.1
Druglikeness	0.65801
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68421
Fragments	1
Non HAtoms	19
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
StereoCon

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