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

Formula:C17H9N2O3BrCl2 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-1-(3-bromophenyl)-5-[(2,4-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-(3-bromophenyl)-5-[(2,4-dichlorophenyl)methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C17H9N2O3BrCl2
Smiles	O=C(/C(/C(N1c2cccc(Br)c2)=O)=C\c(ccc(Cl)c2)c2Cl)NC1=O
InChI	InChI=1S/C17H9BrCl2N2O3/c18-10-2-1-3-12(7-10)22-16(24)13(15(23)21-17(22)25)6-9-4-5-11(19)8-14(9)20/h1-8H,(H,21,23,25)
InChIK	PTXDSYXVGAVMPD-UHFFFAOYSA-N
TotalMolweight	440.079
Molweight	440.079
MonoisotopicMass	437.917358
CLogP	4.0926
CLogS	-6.193
H Acceptors	5
H Donors	1
TotalSurfaceArea	268.71
Relative PSA	0.20144
PolarSurfaceArea	66.48
Druglikeness	2.9594
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Amides	2
StereoCon

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