(2Z)-2-[[4-(trifluoromethyl)phenyl]methylidene]-3,4-dihydronaphthalen-1-one

Formula:C18H13OF3 Mutagenic:none Tumorigenic:none Reproductive Effective:high (2Z)-2-[[4-(trifluoromethyl)phenyl]methylidene]-3,4-dihydronaphthalen-1-one is a drug-like molecule.

MolName	(2Z)-2-[[4-(trifluoromethyl)phenyl]methylidene]-3,4-dihydronaphthalen-1-one
MolecularFormula	C18H13OF3
Smiles	O=C(/C(/CC1)=C\c2ccc(C(F)(F)F)cc2)c2c1cccc2
InChI	InChI=1S/C18H13F3O/c19-18(20,21)15-9-5-12(6-10-15)11-14-8-7-13-3-1-2-4-16(13)17(14)22/h1-6,9-11H,7-8H2
InChIK	LBNIGWMJPRKFKZ-UHFFFAOYSA-N
TotalMolweight	302.294
Molweight	302.294
MonoisotopicMass	302.091849
CLogP	4.8611
CLogS	-5.061
H Acceptors	1
TotalSurfaceArea	218.96
Relative PSA	0.059554
PolarSurfaceArea	17.07
Druglikeness	-7.434
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.59091
Fragments	1
Non HAtoms	22
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	4
StereoCon

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