(2E)-2-[[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1-benzothiophen-3-one

Formula:C20H11O2F3S Mutagenic:high Tumorigenic:high Reproductive Effective:none (2E)-2-[[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1-benzothiophen-3-one is a drug-like molecule.

MolName	(2E)-2-[[5-[2-(trifluoromethyl)phenyl]furan-2-yl]methylidene]-1-benzothiophen-3-one
MolecularFormula	C20H11O2F3S
Smiles	O=C1c(cccc2)c2S/C1=C/c1ccc(-c2c(C(F)(F)F)cccc2)o1
InChI	InChI=1S/C20H11F3O2S/c21-20(22,23)15-7-3-1-5-13(15)16-10-9-12(25-16)11-18-19(24)14-6-2-4-8-17(14)26-18/h1-11H
InChIK	BPFPYSNNJCEBLS-UHFFFAOYSA-N
TotalMolweight	372.365
Molweight	372.365
MonoisotopicMass	372.043184
CLogP	4.8569
CLogS	-6.994
H Acceptors	2
TotalSurfaceArea	258.38
Relative PSA	0.17277
PolarSurfaceArea	55.51
Druglikeness	-4.6565
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	3
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	2
Symmetricatoms	2
StereoCon

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