(E)-3-(4-chloro-2-fluoroanilino)-1-(4-fluorophenyl)prop-2-en-1-one

Formula:C15H10NOClF2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-chloro-2-fluoroanilino)-1-(4-fluorophenyl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-(4-chloro-2-fluoroanilino)-1-(4-fluorophenyl)prop-2-en-1-one
MolecularFormula	C15H10NOClF2
Smiles	O=C(/C=C/Nc(ccc(Cl)c1)c1F)c(cc1)ccc1F
InChI	InChI=1S/C15H10ClF2NO/c16-11-3-6-14(13(18)9-11)19-8-7-15(20)10-1-4-12(17)5-2-10/h1-9,19H
InChIK	BQVRZIYBZMHQFA-UHFFFAOYSA-N
TotalMolweight	293.699
Molweight	293.699
MonoisotopicMass	293.041897
CLogP	3.2821
CLogS	-5.15
H Acceptors	2
H Donors	1
TotalSurfaceArea	216.85
Relative PSA	0.11298
PolarSurfaceArea	29.1
Druglikeness	-0.68199
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Symmetricatoms	2
StereoCon

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