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

Formula:C24H21N2O2Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-N-(3-chloro-2-piperidin-1-ylphenyl)-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide is not a drug-like molecule.

MolName	(E)-N-(3-chloro-2-piperidin-1-ylphenyl)-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide
MolecularFormula	C24H21N2O2Cl3
Smiles	O=C(/C=C/c1ccc(-c(ccc(Cl)c2)c2Cl)o1)Nc(cccc1Cl)c1N1CCCCC1
InChI	InChI=1S/C24H21Cl3N2O2/c25-16-7-10-18(20(27)15-16)22-11-8-17(31-22)9-12-23(30)28-21-6-4-5-19(26)24(21)29-13-2-1-3-14-29/h4-12,15H,1-3,13-14H2,(H,28,30)
InChIK	ZNJZLVBXXOCZKD-UHFFFAOYSA-N
TotalMolweight	475.802
Molweight	475.802
MonoisotopicMass	474.066859
CLogP	6.7262
CLogS	-8.158
H Acceptors	4
H Donors	1
TotalSurfaceArea	350.04
Relative PSA	0.12044
PolarSurfaceArea	45.48
Druglikeness	1.2713
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	6
Symmetricatoms	2
Amides	1
Amines	1
Aromatic Amines	1
StereoCon

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