(5E)-1-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Formula:C18H12N2O4Cl2 Mutagenic:low Tumorigenic:none Reproductive Effective:high (5E)-1-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C18H12N2O4Cl2
Smiles	Oc(c(Cl)cc(/C=C(\C(NC(N1Cc2ccccc2)=O)=O)/C1=O)c1)c1Cl
InChI	InChI=1S/C18H12Cl2N2O4/c19-13-7-11(8-14(20)15(13)23)6-12-16(24)21-18(26)22(17(12)25)9-10-4-2-1-3-5-10/h1-8,23H,9H2,(H,21,24,26)
InChIK	AMSUXLKZSINTPF-UHFFFAOYSA-N
TotalMolweight	391.209
Molweight	391.209
MonoisotopicMass	390.017412
CLogP	2.9446
CLogS	-4.541
H Acceptors	6
H Donors	2
TotalSurfaceArea	270.19
Relative PSA	0.24882
PolarSurfaceArea	86.71
Druglikeness	5.7879
Mutagenic	low
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	5
Amides	2
StereoCon

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1 - (5E)-1-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione | 2 - (5E)-1-benzyl-5-[(3,5-dichloro-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

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