(5Z)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-3-[(2-fluorophenyl)methyl]imidazolidine-2,4-dione

Formula:C17H12N2O3BrF Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-3-[(2-fluorophenyl)methyl]imidazolidine-2,4-dione is a drug-like molecule.

MolName(5Z)-5-[(3-bromo-4-hydroxyphenyl)methylidene]-3-[(2-fluorophenyl)methyl]imidazolidine-2,4-dione
MolecularFormulaC17H12N2O3BrF
SmilesOc(ccc(/C=C(/C(N1Cc(cccc2)c2F)=O)\NC1=O)c1)c1Br
InChIInChI=1S/C17H12BrFN2O3/c18-12-7-10(5-6-15(12)22)8-14-16(23)21(17(24)20-14)9-11-3-1-2-4-13(11)19/h1-8,22H,9H2,(H,20,24)
InChIKGOFYQDJHSHQQDZ-UHFFFAOYSA-N
TotalMolweight391.195
Molweight391.195
MonoisotopicMass390.001532
CLogP3.0196
CLogS-4.549
H Acceptors5
H Donors2
TotalSurfaceArea246.58
Relative PSA0.21977
PolarSurfaceArea69.64
Druglikeness1.7317
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionslimit! 5-methylene-imidazolidine-2,4-dione
Shape Index0.58333
Fragments1
Non HAtoms24
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond3
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Amides2
StereoCon

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