5-nitro-6-[(E)-2-[3-[(2-nitrophenyl)methoxy]phenyl]ethenyl]-1H-pyrimidine-2,4-dione

Formula:C19H14N4O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none 5-nitro-6-[(E)-2-[3-[(2-nitrophenyl)methoxy]phenyl]ethenyl]-1H-pyrimidine-2,4-dione is not a drug-like molecule.

MolName	5-nitro-6-[(E)-2-[3-[(2-nitrophenyl)methoxy]phenyl]ethenyl]-1H-pyrimidine-2,4-dione
MolecularFormula	C19H14N4O7
Smiles	[O-][N+](c1c(COc2cccc(/C=C/C(NC(NC3=O)=O)=C3[N+]([O-])=O)c2)cccc1)=O
InChI	InChI=1S/C19H14N4O7/c24-18-17(23(28)29)15(20-19(25)21-18)9-8-12-4-3-6-14(10-12)30-11-13-5-1-2-7-16(13)22(26)27/h1-10H,11H2,(H2,20,21,24,25)
InChIK	KUTFBPKMAMJEQW-UHFFFAOYSA-N
TotalMolweight	410.341
Molweight	410.341
MonoisotopicMass	410.086251
CLogP	0.7225
CLogS	-5.207
H Acceptors	11
H Donors	2
TotalSurfaceArea	298.46
Relative PSA	0.40153
PolarSurfaceArea	159.07
Druglikeness	-3.006
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.5
Fragments	1
Non HAtoms	30
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Amides	2
AcidicOxygens	2
StereoCon

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