(5Z)-5-[(4-chlorophenyl)methylidene]-3-(4-fluorophenyl)-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazol-4-one

Formula:C20H13N2OClF4S Mutagenic:none Tumorigenic:none Reproductive Effective:none (5Z)-5-[(4-chlorophenyl)methylidene]-3-(4-fluorophenyl)-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazol-4-one is not a drug-like molecule.

MolName	(5Z)-5-[(4-chlorophenyl)methylidene]-3-(4-fluorophenyl)-2-(3,4,4-trifluorobut-3-enylsulfanyl)imidazol-4-one
MolecularFormula	C20H13N2OClF4S
Smiles	O=C(/C(/N=C1SCCC(F)=C(F)F)=C/c(cc2)ccc2Cl)N1c(cc1)ccc1F
InChI	InChI=1S/C20H13ClF4N2OS/c21-13-3-1-12(2-4-13)11-17-19(28)27(15-7-5-14(22)6-8-15)20(26-17)29-10-9-16(23)18(24)25/h1-8,11H,9-10H2
InChIK	HXIAENYHAWBELE-UHFFFAOYSA-N
TotalMolweight	440.847
Molweight	440.847
MonoisotopicMass	440.037322
CLogP	6.0531
CLogS	-9.111
H Acceptors	3
TotalSurfaceArea	304
Relative PSA	0.14997
PolarSurfaceArea	57.97
Druglikeness	-1.1698
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	5
Amides	1
StereoCon

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