(E)-1,3-bis[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one

Formula:C25H14O3F6 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-1,3-bis[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-1,3-bis[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one
MolecularFormula	C25H14O3F6
Smiles	O=C(/C=C/c1ccc(-c2cc(C(F)(F)F)ccc2)o1)c1ccc(-c2cccc(C(F)(F)F)c2)o1
InChI	InChI=1S/C25H14F6O3/c26-24(27,28)17-5-1-3-15(13-17)21-10-8-19(33-21)7-9-20(32)23-12-11-22(34-23)16-4-2-6-18(14-16)25(29,30)31/h1-14H
InChIK	IRRFLJJHVMCCFV-UHFFFAOYSA-N
TotalMolweight	476.371
Molweight	476.371
MonoisotopicMass	476.084713
CLogP	6.8782
CLogS	-8.316
H Acceptors	3
TotalSurfaceArea	335.09
Relative PSA	0.12313
PolarSurfaceArea	43.35
Druglikeness	-5.1395
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55882
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	4
StereoCon

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