3-bromo-N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide

Formula:C18H17N2O4Br Mutagenic:high Tumorigenic:none Reproductive Effective:none 3-bromo-N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	3-bromo-N-[(Z)-1-(furan-2-yl)-3-morpholin-4-yl-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C18H17N2O4Br
Smiles	O=C(/C(/NC(c1cccc(Br)c1)=O)=C/c1ccco1)N1CCOCC1
InChI	InChI=1S/C18H17BrN2O4/c19-14-4-1-3-13(11-14)17(22)20-16(12-15-5-2-8-25-15)18(23)21-6-9-24-10-7-21/h1-5,8,11-12H,6-7,9-10H2,(H,20,22)
InChIK	YFYAMWVXLARDKX-UHFFFAOYSA-N
TotalMolweight	405.247
Molweight	405.247
MonoisotopicMass	404.037169
CLogP	2.8645
CLogS	-3.587
H Acceptors	6
H Donors	1
TotalSurfaceArea	274.85
Relative PSA	0.23722
PolarSurfaceArea	71.78
Druglikeness	2.8097
Mutagenic	high
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	5
Symmetricatoms	2
Amides	2
StereoCon

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