(E)-3-[3,5-bis(trifluoromethyl)anilino]-1-(4-phenylphenyl)prop-2-en-1-one

Formula:C23H15NOF6 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[3,5-bis(trifluoromethyl)anilino]-1-(4-phenylphenyl)prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-3-[3,5-bis(trifluoromethyl)anilino]-1-(4-phenylphenyl)prop-2-en-1-one
MolecularFormula	C23H15NOF6
Smiles	O=C(/C=C/Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c(cc1)ccc1-c1ccccc1
InChI	InChI=1S/C23H15F6NO/c24-22(25,26)18-12-19(23(27,28)29)14-20(13-18)30-11-10-21(31)17-8-6-16(7-9-17)15-4-2-1-3-5-15/h1-14,30H
InChIK	YZNSASLDRXVXFU-UHFFFAOYSA-N
TotalMolweight	435.366
Molweight	435.366
MonoisotopicMass	435.105782
CLogP	5.8303
CLogS	-7.428
H Acceptors	2
H Donors	1
TotalSurfaceArea	307.41
Relative PSA	0.079698
PolarSurfaceArea	29.1
Druglikeness	-6.6047
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.54839
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	12
StereoCon

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