N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide

Formula:C25H23N2O3Br Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	N-[(Z)-1-[5-(4-bromophenyl)furan-2-yl]-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide
MolecularFormula	C25H23N2O3Br
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1ccc(-c(cc2)ccc2Br)o1)N1CCCCC1
InChI	InChI=1S/C25H23BrN2O3/c26-20-11-9-18(10-12-20)23-14-13-21(31-23)17-22(25(30)28-15-5-2-6-16-28)27-24(29)19-7-3-1-4-8-19/h1,3-4,7-14,17H,2,5-6,15-16H2,(H,27,29)
InChIK	DOQLUGHAFIOQAB-UHFFFAOYSA-N
TotalMolweight	479.373
Molweight	479.373
MonoisotopicMass	478.089204
CLogP	5.7787
CLogS	-6.254
H Acceptors	5
H Donors	1
TotalSurfaceArea	338.37
Relative PSA	0.16314
PolarSurfaceArea	62.55
Druglikeness	2.5656
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51613
Fragments	1
Non HAtoms	31
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	5
Symmetricatoms	6
Amides	2
StereoCon

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