(E)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(3-chloro-2-piperidin-1-ylphenyl)prop-2-enamide

Formula:C24H22N2O2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(3-chloro-2-piperidin-1-ylphenyl)prop-2-enamide is not a drug-like molecule.

MolName	(E)-3-[5-(4-chlorophenyl)furan-2-yl]-N-(3-chloro-2-piperidin-1-ylphenyl)prop-2-enamide
MolecularFormula	C24H22N2O2Cl2
Smiles	O=C(/C=C/c1ccc(-c(cc2)ccc2Cl)o1)Nc1cccc(Cl)c1N1CCCCC1
InChI	InChI=1S/C24H22Cl2N2O2/c25-18-9-7-17(8-10-18)22-13-11-19(30-22)12-14-23(29)27-21-6-4-5-20(26)24(21)28-15-2-1-3-16-28/h4-14H,1-3,15-16H2,(H,27,29)
InChIK	CFOVBBPQLYNJDJ-UHFFFAOYSA-N
TotalMolweight	441.357
Molweight	441.357
MonoisotopicMass	440.105832
CLogP	6.1202
CLogS	-7.422
H Acceptors	4
H Donors	1
TotalSurfaceArea	334.62
Relative PSA	0.12599
PolarSurfaceArea	45.48
Druglikeness	1.2713
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	6
Symmetricatoms	4
Amides	1
Amines	1
Aromatic Amines	1
StereoCon

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