N-[(E)-1-(2-hydroxyphenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide

Formula:C21H22N2O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(E)-1-(2-hydroxyphenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-1-(2-hydroxyphenyl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]benzamide
MolecularFormula	C21H22N2O3
Smiles	Oc1c(/C=C(\C(N2CCCCC2)=O)/NC(c2ccccc2)=O)cccc1
InChI	InChI=1S/C21H22N2O3/c24-19-12-6-5-11-17(19)15-18(21(26)23-13-7-2-8-14-23)22-20(25)16-9-3-1-4-10-16/h1,3-6,9-12,15,24H,2,7-8,13-14H2,(H,22,25)
InChIK	ISCGKVNKXSNZBY-UHFFFAOYSA-N
TotalMolweight	350.417
Molweight	350.417
MonoisotopicMass	350.163043
CLogP	3.7689
CLogS	-3.664
H Acceptors	5
H Donors	2
TotalSurfaceArea	276.64
Relative PSA	0.19589
PolarSurfaceArea	69.64
Druglikeness	3.6496
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.46154
Fragments	1
Non HAtoms	26
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	4
Amides	2
StereoCon

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