4-[(E)-2-(4-fluoro-3-phenoxyphenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one

Formula:C19H12N2O2F4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(E)-2-(4-fluoro-3-phenoxyphenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one is a drug-like molecule.

MolName	4-[(E)-2-(4-fluoro-3-phenoxyphenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one
MolecularFormula	C19H12N2O2F4
Smiles	O=C1N=C(/C=C/c(cc2)cc(Oc3ccccc3)c2F)C=C(C(F)(F)F)N1
InChI	InChI=1S/C19H12F4N2O2/c20-15-9-7-12(10-16(15)27-14-4-2-1-3-5-14)6-8-13-11-17(19(21,22)23)25-18(26)24-13/h1-11H,(H,24,25,26)
InChIK	FELDWEPLTWLHPN-UHFFFAOYSA-N
TotalMolweight	376.308
Molweight	376.308
MonoisotopicMass	376.08349
CLogP	4.3226
CLogS	-6.91
H Acceptors	4
H Donors	1
TotalSurfaceArea	268.72
Relative PSA	0.17122
PolarSurfaceArea	50.69
Druglikeness	-5.4895
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	4
Amides	1
BasicNitrogens	1
StereoCon

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