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

Formula:C18H14N2O5 Mutagenic:low Tumorigenic:none Reproductive Effective:high (5E)-1-benzyl-5-[(2,4-dihydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-benzyl-5-[(2,4-dihydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C18H14N2O5
Smiles	Oc1cc(O)c(/C=C(\C(NC(N2Cc3ccccc3)=O)=O)/C2=O)cc1
InChI	InChI=1S/C18H14N2O5/c21-13-7-6-12(15(22)9-13)8-14-16(23)19-18(25)20(17(14)24)10-11-4-2-1-3-5-11/h1-9,21-22H,10H2,(H,19,23,25)
InChIK	JBLCVRXADNMMFR-UHFFFAOYSA-N
TotalMolweight	338.318
Molweight	338.318
MonoisotopicMass	338.090273
CLogP	1.3869
CLogS	-2.773
H Acceptors	7
H Donors	3
TotalSurfaceArea	245.7
Relative PSA	0.32694
PolarSurfaceArea	106.94
Druglikeness	5.7425
Mutagenic	low
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.56
Fragments	1
Non HAtoms	25
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	2
Amides	2
StereoCon

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