(5E)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione

Formula:C24H15N3O6ClF Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-5-[[5-chloro-2-[(2-fluorophenyl)methoxy]phenyl]methylidene]-1-(3-nitrophenyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C24H15N3O6ClF
Smiles	[O-][N+](c1cccc(N(C(/C(/C(N2)=O)=C/c(cc(cc3)Cl)c3OCc(cccc3)c3F)=O)C2=O)c1)=O
InChI	InChI=1S/C24H15ClFN3O6/c25-16-8-9-21(35-13-14-4-1-2-7-20(14)26)15(10-16)11-19-22(30)27-24(32)28(23(19)31)17-5-3-6-18(12-17)29(33)34/h1-12H,13H2,(H,27,30,32)
InChIK	PDYAQUCUMOBZSW-UHFFFAOYSA-N
TotalMolweight	495.849
Molweight	495.849
MonoisotopicMass	495.063342
CLogP	3.2887
CLogS	-6.738
H Acceptors	9
H Donors	1
TotalSurfaceArea	348.2
Relative PSA	0.27154
PolarSurfaceArea	121.53
Druglikeness	-1.7666
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB; aromatic nitro
Shape Index	0.48571
Fragments	1
Non HAtoms	35
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Amides	2
AcidicOxygens	1
StereoCon

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