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

Formula:C23H22N2O5 Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-1-(oxolan-2-ylmethyl)-5-[(4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName	(5E)-1-(oxolan-2-ylmethyl)-5-[(4-phenylmethoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione
MolecularFormula	C23H22N2O5
Smiles	O=C(/C(/C(N1CC2OCCC2)=O)=C\c(cc2)ccc2OCc2ccccc2)NC1=O
InChI	InChI=1S/C23H22N2O5/c26-21-20(22(27)25(23(28)24-21)14-19-7-4-12-29-19)13-16-8-10-18(11-9-16)30-15-17-5-2-1-3-6-17/h1-3,5-6,8-11,13,19H,4,7,12,14-15H2,(H,24,26,28)/t19-/m1/s1
InChIK	UAXKSXCPTYKXJA-LJQANCHMSA-N
TotalMolweight	406.437
Molweight	406.437
MonoisotopicMass	406.152873
CLogP	2.3081
CLogS	-4.068
H Acceptors	7
H Donors	1
TotalSurfaceArea	307.04
Relative PSA	0.24143
PolarSurfaceArea	84.94
Druglikeness	4.2857
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	twice activated DB
Shape Index	0.6
Fragments	1
Non HAtoms	30
NonCHAtoms	7
Electronegative Atoms	7
StereoCenters	1
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	8
Symmetricatoms	4
Amides	2
StereoCon	racemate

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

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