N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide

Formula:C24H20N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:high N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-1-(1,3-benzodioxol-5-yl)-3-(benzylamino)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C24H20N2O4
Smiles	O=C(/C(/NC(c1ccccc1)=O)=C\c(cc1)cc2c1OCO2)NCc1ccccc1
InChI	InChI=1S/C24H20N2O4/c27-23(19-9-5-2-6-10-19)26-20(24(28)25-15-17-7-3-1-4-8-17)13-18-11-12-21-22(14-18)30-16-29-21/h1-14H,15-16H2,(H,25,28)(H,26,27)
InChIK	HRRSBVXFGXHZHB-UHFFFAOYSA-N
TotalMolweight	400.433
Molweight	400.433
MonoisotopicMass	400.142308
CLogP	4.2446
CLogS	-5.4
H Acceptors	6
H Donors	2
TotalSurfaceArea	309.93
Relative PSA	0.22263
PolarSurfaceArea	76.66
Druglikeness	3.3369
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.46667
Fragments	1
Non HAtoms	30
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
Amides	2
StereoCon

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