(5E)-5-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione

Formula:C24H23N2O4Cl Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName(5E)-5-[[2-[(2-chlorophenyl)methoxy]phenyl]methylidene]-1-cyclohexyl-1,3-diazinane-2,4,6-trione
MolecularFormulaC24H23N2O4Cl
SmilesO=C(/C(/C(N1C2CCCCC2)=O)=C\c(cccc2)c2OCc(cccc2)c2Cl)NC1=O
InChIInChI=1S/C24H23ClN2O4/c25-20-12-6-4-9-17(20)15-31-21-13-7-5-8-16(21)14-19-22(28)26-24(30)27(23(19)29)18-10-2-1-3-11-18/h4-9,12-14,18H,1-3,10-11,15H2,(H,26,28,30)
InChIKQZVKJVOIESJGLW-UHFFFAOYSA-N
TotalMolweight438.91
Molweight438.91
MonoisotopicMass438.134635
CLogP4.17
CLogS-5.693
H Acceptors6
H Donors1
TotalSurfaceArea326.22
Relative PSA0.19659
PolarSurfaceArea75.71
Druglikeness-0.50008
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionstwice activated DB
Shape Index0.51613
Fragments1
Non HAtoms31
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms8
Symmetricatoms2
Amides2
StereoCon

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