(E)-2-cyano-3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-(2-fluorophenyl)prop-2-enamide

Formula:C20H11N2O2Cl2F Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-2-cyano-3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-(2-fluorophenyl)prop-2-enamide is not a drug-like molecule.

MolName	(E)-2-cyano-3-[5-(2,3-dichlorophenyl)furan-2-yl]-N-(2-fluorophenyl)prop-2-enamide
MolecularFormula	C20H11N2O2Cl2F
Smiles	N#C/C(/C(Nc(cccc1)c1F)=O)=C\c1ccc(-c2cccc(Cl)c2Cl)o1
InChI	InChI=1S/C20H11Cl2FN2O2/c21-15-5-3-4-14(19(15)22)18-9-8-13(27-18)10-12(11-24)20(26)25-17-7-2-1-6-16(17)23/h1-10H,(H,25,26)
InChIK	XFSYPNVECFXHCW-UHFFFAOYSA-N
TotalMolweight	401.223
Molweight	401.223
MonoisotopicMass	400.01816
CLogP	5.24
CLogS	-7.016
H Acceptors	4
H Donors	1
TotalSurfaceArea	295.29
Relative PSA	0.17667
PolarSurfaceArea	66.03
Druglikeness	-2.0433
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	17
Amides	1
StereoCon

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