(E)-3-[3-chloro-4-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-2-cyano-N-phenylprop-2-enamide

Formula:C24H17N3O3ClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-[3-chloro-4-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-2-cyano-N-phenylprop-2-enamide is a drug-like molecule.

MolName	(E)-3-[3-chloro-4-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-2-cyano-N-phenylprop-2-enamide
MolecularFormula	C24H17N3O3ClF
Smiles	N#C/C(/C(Nc1ccccc1)=O)=C\c(cc1)cc(Cl)c1OCC(Nc(cccc1)c1F)=O
InChI	InChI=1S/C24H17ClFN3O3/c25-19-13-16(12-17(14-27)24(31)28-18-6-2-1-3-7-18)10-11-22(19)32-15-23(30)29-21-9-5-4-8-20(21)26/h1-13H,15H2,(H,28,31)(H,29,30)
InChIK	NCHKXQNJYBVOAZ-UHFFFAOYSA-N
TotalMolweight	449.868
Molweight	449.868
MonoisotopicMass	449.094247
CLogP	4.4175
CLogS	-6.112
H Acceptors	6
H Donors	2
TotalSurfaceArea	343.15
Relative PSA	0.21145
PolarSurfaceArea	91.22
Druglikeness	-3.0463
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	2
Amides	2
StereoCon

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