(5E)-3-[(2-fluorophenyl)methyl]-5-[(5-phenylsulfanylfuran-2-yl)methylidene]imidazolidine-2,4-dione

Formula:C21H15N2O3FS Mutagenic:high Tumorigenic:high Reproductive Effective:none (5E)-3-[(2-fluorophenyl)methyl]-5-[(5-phenylsulfanylfuran-2-yl)methylidene]imidazolidine-2,4-dione is a drug-like molecule.

MolName(5E)-3-[(2-fluorophenyl)methyl]-5-[(5-phenylsulfanylfuran-2-yl)methylidene]imidazolidine-2,4-dione
MolecularFormulaC21H15N2O3FS
SmilesO=C(/C(/N1)=C\c(o2)ccc2Sc2ccccc2)N(Cc(cccc2)c2F)C1=O
InChIInChI=1S/C21H15FN2O3S/c22-17-9-5-4-6-14(17)13-24-20(25)18(23-21(24)26)12-15-10-11-19(27-15)28-16-7-2-1-3-8-16/h1-12H,13H2,(H,23,26)
InChIKYAAIZQNTEYBBHG-UHFFFAOYSA-N
TotalMolweight394.425
Molweight394.425
MonoisotopicMass394.078741
CLogP3.7473
CLogS-5.242
H Acceptors5
H Donors1
TotalSurfaceArea288.54
Relative PSA0.25192
PolarSurfaceArea87.85
Druglikeness4.6216
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! 5-methylene-imidazolidine-2,4-dione
Shape Index0.60714
Fragments1
Non HAtoms28
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures4
Small Rings4
Aromatic Rings3
Aromatic Atoms17
Sp3Atoms2
Symmetricatoms2
Amides2
StereoCon

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