4-[(E)-2-[4-[(4-fluorophenyl)methoxy]phenyl]ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one

Formula:C20H14N2O2F4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(E)-2-[4-[(4-fluorophenyl)methoxy]phenyl]ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one is a drug-like molecule.

MolName	4-[(E)-2-[4-[(4-fluorophenyl)methoxy]phenyl]ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one
MolecularFormula	C20H14N2O2F4
Smiles	O=C1N=C(/C=C/c(cc2)ccc2OCc(cc2)ccc2F)C=C(C(F)(F)F)N1
InChI	InChI=1S/C20H14F4N2O2/c21-15-6-1-14(2-7-15)12-28-17-9-4-13(5-10-17)3-8-16-11-18(20(22,23)24)26-19(27)25-16/h1-11H,12H2,(H,25,26,27)
InChIK	DZQGQBQBTPOJDD-UHFFFAOYSA-N
TotalMolweight	390.335
Molweight	390.335
MonoisotopicMass	390.09914
CLogP	4.2751
CLogS	-5.954
H Acceptors	4
H Donors	1
TotalSurfaceArea	282.48
Relative PSA	0.16288
PolarSurfaceArea	50.69
Druglikeness	-5.6604
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64286
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	6
Amides	1
BasicNitrogens	1
StereoCon

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