(E)-3-[5-chloro-2-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-N-(2-chlorophenyl)-2-cyanoprop-2-enamide

Formula:C24H16N3O3Cl2F Mutagenic:none Tumorigenic:none Reproductive Effective:high (E)-3-[5-chloro-2-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-N-(2-chlorophenyl)-2-cyanoprop-2-enamide is not a drug-like molecule.

MolName	(E)-3-[5-chloro-2-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-N-(2-chlorophenyl)-2-cyanoprop-2-enamide
MolecularFormula	C24H16N3O3Cl2F
Smiles	N#C/C(/C(Nc(cccc1)c1Cl)=O)=C\c(cc(cc1)Cl)c1OCC(Nc(cccc1)c1F)=O
InChI	InChI=1S/C24H16Cl2FN3O3/c25-17-9-10-22(33-14-23(31)29-21-8-4-2-6-19(21)27)15(12-17)11-16(13-28)24(32)30-20-7-3-1-5-18(20)26/h1-12H,14H2,(H,29,31)(H,30,32)
InChIK	XNZDXNRURZNRHM-UHFFFAOYSA-N
TotalMolweight	484.313
Molweight	484.313
MonoisotopicMass	483.055274
CLogP	5.0235
CLogS	-6.848
H Acceptors	6
H Donors	2
TotalSurfaceArea	358.57
Relative PSA	0.20236
PolarSurfaceArea	91.22
Druglikeness	-3.0463
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Nasty Functions	twice activated DB
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Amides	2
StereoCon

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1 - (E)-3-[5-chloro-2-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-N-(2-chlorophenyl)-2-cyanoprop-2-enamide | 2 - (E)-3-[5-chloro-2-[2-(2-fluoroanilino)-2-oxoethoxy]phenyl]-N-(2-chlorophenyl)-2-cyanoprop-2-enamide

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