N-[(Z)-1-(furan-2-yl)-3-oxo-3-(2-piperidin-1-ylethylamino)prop-1-en-2-yl]benzamide

Formula:C21H25N3O3 Mutagenic:high Tumorigenic:none Reproductive Effective:none N-[(Z)-1-(furan-2-yl)-3-oxo-3-(2-piperidin-1-ylethylamino)prop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-1-(furan-2-yl)-3-oxo-3-(2-piperidin-1-ylethylamino)prop-1-en-2-yl]benzamide
MolecularFormula	C21H25N3O3
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C/c1ccco1)NCCN1CCCCC1
InChI	InChI=1S/C21H25N3O3/c25-20(17-8-3-1-4-9-17)23-19(16-18-10-7-15-27-18)21(26)22-11-14-24-12-5-2-6-13-24/h1,3-4,7-10,15-16H,2,5-6,11-14H2,(H,22,26)(H,23,25)
InChIK	ALEXWYIOHWVYQP-UHFFFAOYSA-N
TotalMolweight	367.448
Molweight	367.448
MonoisotopicMass	367.189592
CLogP	2.7366
CLogS	-3.427
H Acceptors	6
H Donors	2
TotalSurfaceArea	298.96
Relative PSA	0.22297
PolarSurfaceArea	74.58
Druglikeness	4.0392
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.55556
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	8
Symmetricatoms	4
Amides	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
StereoCon

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