N-[4-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]phenyl]benzamide

Formula:C26H19N3O5 Mutagenic:high Tumorigenic:high Reproductive Effective:none N-[4-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]phenyl]benzamide is a drug-like molecule.

MolName	N-[4-[[(E)-3-[5-(2-nitrophenyl)furan-2-yl]prop-2-enoyl]amino]phenyl]benzamide
MolecularFormula	C26H19N3O5
Smiles	[O-][N+](c(cccc1)c1-c1ccc(/C=C/C(Nc(cc2)ccc2NC(c2ccccc2)=O)=O)o1)=O
InChI	InChI=1S/C26H19N3O5/c30-25(17-15-21-14-16-24(34-21)22-8-4-5-9-23(22)29(32)33)27-19-10-12-20(13-11-19)28-26(31)18-6-2-1-3-7-18/h1-17H,(H,27,30)(H,28,31)
InChIK	GPFRIFPOSCXOAD-UHFFFAOYSA-N
TotalMolweight	453.453
Molweight	453.453
MonoisotopicMass	453.132472
CLogP	4.3011
CLogS	-6.93
H Acceptors	8
H Donors	2
TotalSurfaceArea	350.82
Relative PSA	0.2666
PolarSurfaceArea	117.16
Druglikeness	-4.0044
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	1
Symmetricatoms	4
Amides	2
AcidicOxygens	1
StereoCon

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