(E)-2-cyano-3-[2-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]-N-(4-fluorophenyl)prop-2-enamide

Formula:C24H17N3O3F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-cyano-3-[2-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]-N-(4-fluorophenyl)prop-2-enamide is a drug-like molecule.

MolName	(E)-2-cyano-3-[2-[2-(4-fluoroanilino)-2-oxoethoxy]phenyl]-N-(4-fluorophenyl)prop-2-enamide
MolecularFormula	C24H17N3O3F2
Smiles	N#C/C(/C(Nc(cc1)ccc1F)=O)=C\c(cccc1)c1OCC(Nc(cc1)ccc1F)=O
InChI	InChI=1S/C24H17F2N3O3/c25-18-5-9-20(10-6-18)28-23(30)15-32-22-4-2-1-3-16(22)13-17(14-27)24(31)29-21-11-7-19(26)8-12-21/h1-13H,15H2,(H,28,30)(H,29,31)
InChIK	MMWUNKZACUZFDF-UHFFFAOYSA-N
TotalMolweight	433.413
Molweight	433.413
MonoisotopicMass	433.123798
CLogP	3.9123
CLogS	-5.69
H Acceptors	6
H Donors	2
TotalSurfaceArea	334.08
Relative PSA	0.21719
PolarSurfaceArea	91.22
Druglikeness	-3.1154
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.625
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Symmetricatoms	4
Amides	2
StereoCon

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