(4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione

Formula:C24H15NO3BrF3 Mutagenic:none Tumorigenic:none Reproductive Effective:low (4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione is not a drug-like molecule.

MolName	(4E)-5-(4-bromophenyl)-4-[hydroxy(phenyl)methylidene]-1-[3-(trifluoromethyl)phenyl]pyrrolidine-2,3-dione
MolecularFormula	C24H15NO3BrF3
Smiles	O/C(/c1ccccc1)=C(\C(c(cc1)ccc1Br)N(C1=O)c2cc(C(F)(F)F)ccc2)/C1=O
InChI	InChI=1S/C24H15BrF3NO3/c25-17-11-9-14(10-12-17)20-19(21(30)15-5-2-1-3-6-15)22(31)23(32)29(20)18-8-4-7-16(13-18)24(26,27)28/h1-13,20,30H/t20-/m1/s1
InChIK	NWNQWXHPGZIJCY-HXUWFJFHSA-N
TotalMolweight	502.285
Molweight	502.285
MonoisotopicMass	501.018739
CLogP	5.0078
CLogS	-5.605
H Acceptors	4
H Donors	1
TotalSurfaceArea	314.94
Relative PSA	0.13568
PolarSurfaceArea	57.61
Druglikeness	-9.5653
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.40625
Fragments	1
Non HAtoms	32
NonCHAtoms	8
Electronegative Atoms	8
StereoCenters	1
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	3
Symmetricatoms	6
Amides	1
StereoCon	racemate

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