(5E)-1-(4-bromophenyl)-5-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione

Formula:C25H18N2O5BrCl Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-1-(4-bromophenyl)-5-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione is not a drug-like molecule.

MolName	(5E)-1-(4-bromophenyl)-5-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C25H18N2O5BrCl
Smiles	O=C(/C(/C(N1c(cc2)ccc2Br)=O)=C\c(cc2)ccc2OCCOc(cccc2)c2Cl)NC1=O
InChI	InChI=1S/C25H18BrClN2O5/c26-17-7-9-18(10-8-17)29-24(31)20(23(30)28-25(29)32)15-16-5-11-19(12-6-16)33-13-14-34-22-4-2-1-3-21(22)27/h1-12,15H,13-14H2,(H,28,30,32)
InChIK	WAXPHPUFZKQNQK-UHFFFAOYSA-N
TotalMolweight	541.784
Molweight	541.784
MonoisotopicMass	540.008761
CLogP	4.8416
CLogS	-6.725
H Acceptors	7
H Donors	1
TotalSurfaceArea	360.57
Relative PSA	0.20559
PolarSurfaceArea	84.94
Druglikeness	-4.0941
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	low
Nasty Functions	twice activated DB
Shape Index	0.61765
Fragments	1
Non HAtoms	34
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	4
Amides	2
StereoCon

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1 - (5E)-1-(4-bromophenyl)-5-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione | 2 - (5E)-1-(4-bromophenyl)-5-[[4-[2-(2-chlorophenoxy)ethoxy]phenyl]methylidene]-1,3-diazinane-2,4,6-trione

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