(E)-1-[2,4-bis(difluoromethoxy)phenyl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one

Formula:C18H11O3F7 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[2,4-bis(difluoromethoxy)phenyl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one is a drug-like molecule.

MolName	(E)-1-[2,4-bis(difluoromethoxy)phenyl]-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-one
MolecularFormula	C18H11O3F7
Smiles	O=C(/C=C/c1cccc(C(F)(F)F)c1)c(ccc(OC(F)F)c1)c1OC(F)F
InChI	InChI=1S/C18H11F7O3/c19-16(20)27-12-5-6-13(15(9-12)28-17(21)22)14(26)7-4-10-2-1-3-11(8-10)18(23,24)25/h1-9,16-17H
InChIK	YLIWAYHOFACCRR-UHFFFAOYSA-N
TotalMolweight	408.268
Molweight	408.268
MonoisotopicMass	408.059641
CLogP	4.4909
CLogS	-5.862
H Acceptors	3
TotalSurfaceArea	277.13
Relative PSA	0.11922
PolarSurfaceArea	35.53
Druglikeness	-6.725
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53571
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	4
StereoCon

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