1-benzyl-4-[(E)-3-phenylprop-2-enyl]piperazine

Formula:C20H24N2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 1-benzyl-4-[(E)-3-phenylprop-2-enyl]piperazine is a drug-like molecule.

MolName	1-benzyl-4-[(E)-3-phenylprop-2-enyl]piperazine
MolecularFormula	C20H24N2
Smiles	C(/C=C/c1ccccc1)N1CCN(Cc2ccccc2)CC1
InChI	InChI=1S/C20H24N2/c1-3-8-19(9-4-1)12-7-13-21-14-16-22(17-15-21)18-20-10-5-2-6-11-20/h1-12H,13-18H2
InChIK	YWXKCOCOLZXNMU-UHFFFAOYSA-N
TotalMolweight	292.425
Molweight	292.425
MonoisotopicMass	292.193948
CLogP	3.5402
CLogS	-2.539
H Acceptors	2
TotalSurfaceArea	249.18
Relative PSA	0.028493
PolarSurfaceArea	6.48
Druglikeness	6.5715
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.72727
Fragments	1
Non HAtoms	22
NonCHAtoms	2
Electronegative Atoms	2
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	6
Amines	2
AlkylAmines	2
BasicNitrogens	2
StereoCon

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