(5E)-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Formula:C23H17N2O5Br Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-5-[(3-bromo-4-phenylmethoxyphenyl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
MolecularFormula	C23H17N2O5Br
Smiles	O=C(/C(/C(N1Cc2ccco2)=O)=C\c(cc2)cc(Br)c2OCc2ccccc2)NC1=O
InChI	InChI=1S/C23H17BrN2O5/c24-19-12-16(8-9-20(19)31-14-15-5-2-1-3-6-15)11-18-21(27)25-23(29)26(22(18)28)13-17-7-4-10-30-17/h1-12H,13-14H2,(H,25,27,29)
InChIK	DXBJPFYEHIHWID-UHFFFAOYSA-N
TotalMolweight	481.301
Molweight	481.301
MonoisotopicMass	480.032084
CLogP	3.3403
CLogS	-5.222
H Acceptors	7
H Donors	1
TotalSurfaceArea	324.84
Relative PSA	0.24086
PolarSurfaceArea	88.85
Druglikeness	3.5912
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	17
Sp3Atoms	3
Symmetricatoms	2
Amides	2
StereoCon

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