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

Formula:C24H17N2O4F Mutagenic:none Tumorigenic:none Reproductive Effective:high (5E)-5-[[3-[(2-fluorophenyl)methoxy]phenyl]methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione is a drug-like molecule.

MolName(5E)-5-[[3-[(2-fluorophenyl)methoxy]phenyl]methylidene]-1-phenyl-1,3-diazinane-2,4,6-trione
MolecularFormulaC24H17N2O4F
SmilesO=C(/C(/C(N1c2ccccc2)=O)=C\c2cccc(OCc(cccc3)c3F)c2)NC1=O
InChIInChI=1S/C24H17FN2O4/c25-21-12-5-4-8-17(21)15-31-19-11-6-7-16(13-19)14-20-22(28)26-24(30)27(23(20)29)18-9-2-1-3-10-18/h1-14H,15H2,(H,26,28,30)
InChIKLPNNACRHQDVBSF-UHFFFAOYSA-N
TotalMolweight416.407
Molweight416.407
MonoisotopicMass416.117236
CLogP3.6043
CLogS-5.542
H Acceptors6
H Donors1
TotalSurfaceArea309.11
Relative PSA0.20747
PolarSurfaceArea75.71
Druglikeness3.1773
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functionstwice activated DB
Shape Index0.54839
Fragments1
Non HAtoms31
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms18
Sp3Atoms2
Symmetricatoms2
Amides2
StereoCon

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