(E)-3-phenyl-1-(4-phenylpiperidin-1-yl)prop-2-en-1-one

Formula:C20H21NO Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-phenyl-1-(4-phenylpiperidin-1-yl)prop-2-en-1-one is a drug-like molecule.

MolName	(E)-3-phenyl-1-(4-phenylpiperidin-1-yl)prop-2-en-1-one
MolecularFormula	C20H21NO
Smiles	O=C(/C=C/c1ccccc1)N(CC1)CCC1c1ccccc1
InChI	InChI=1S/C20H21NO/c22-20(12-11-17-7-3-1-4-8-17)21-15-13-19(14-16-21)18-9-5-2-6-10-18/h1-12,19H,13-16H2
InChIK	VRGIZZGWMLEWLU-UHFFFAOYSA-N
TotalMolweight	291.393
Molweight	291.393
MonoisotopicMass	291.162314
CLogP	4.5715
CLogS	-3.818
H Acceptors	2
TotalSurfaceArea	241.61
Relative PSA	0.068664
PolarSurfaceArea	20.31
Druglikeness	2.8284
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.68182
Fragments	1
Non HAtoms	22
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	6
Amides	1
StereoCon

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