N-[(E)-3-(furan-2-ylmethylamino)-1-[5-(2-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl]benzamide

Formula:C25H19N3O6 Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[(E)-3-(furan-2-ylmethylamino)-1-[5-(2-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(E)-3-(furan-2-ylmethylamino)-1-[5-(2-nitrophenyl)furan-2-yl]-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C25H19N3O6
Smiles	[O-][N+](c(cccc1)c1-c1ccc(/C=C(\C(NCc2ccco2)=O)/NC(c2ccccc2)=O)o1)=O
InChI	InChI=1S/C25H19N3O6/c29-24(17-7-2-1-3-8-17)27-21(25(30)26-16-19-9-6-14-33-19)15-18-12-13-23(34-18)20-10-4-5-11-22(20)28(31)32/h1-15H,16H2,(H,26,30)(H,27,29)
InChIK	VSCWHVJTVNICKX-UHFFFAOYSA-N
TotalMolweight	457.441
Molweight	457.441
MonoisotopicMass	457.127387
CLogP	3.3392
CLogS	-6.291
H Acceptors	9
H Donors	2
TotalSurfaceArea	352.48
Relative PSA	0.30538
PolarSurfaceArea	130.3
Druglikeness	-1.0031
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.44118
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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