(5E)-1-(furan-2-ylmethyl)-5-[[4-(naphthalen-2-ylmethoxy)phenyl]methylidene]-1,3-diazinane-2,4,6-trione

Formula:C27H20N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-1-(furan-2-ylmethyl)-5-[[4-(naphthalen-2-ylmethoxy)phenyl]methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-(furan-2-ylmethyl)-5-[[4-(naphthalen-2-ylmethoxy)phenyl]methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C27H20N2O5
Smiles	O=C(/C(/C(N1Cc2ccco2)=O)=C\c(cc2)ccc2OCc2cc3ccccc3cc2)NC1=O
InChI	InChI=1S/C27H20N2O5/c30-25-24(26(31)29(27(32)28-25)16-23-6-3-13-33-23)15-18-8-11-22(12-9-18)34-17-19-7-10-20-4-1-2-5-21(20)14-19/h1-15H,16-17H2,(H,28,30,32)
InChIK	XCCPYSPLJMLLIB-UHFFFAOYSA-N
TotalMolweight	452.465
Molweight	452.465
MonoisotopicMass	452.137223
CLogP	3.8095
CLogS	-5.994
H Acceptors	7
H Donors	1
TotalSurfaceArea	340.81
Relative PSA	0.22957
PolarSurfaceArea	88.85
Druglikeness	5.3812
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.58824
Fragments	1
Non HAtoms	34
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	3
Symmetricatoms	2
Amides	2
StereoCon

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