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

Formula:C20H18NO4F Mutagenic:none Tumorigenic:none Reproductive Effective:low (4E)-5-(2-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(3-hydroxypropyl)pyrrolidine-2,3-dione is a drug-like molecule.

MolName	(4E)-5-(2-fluorophenyl)-4-[hydroxy(phenyl)methylidene]-1-(3-hydroxypropyl)pyrrolidine-2,3-dione
MolecularFormula	C20H18NO4F
Smiles	OCCCN(C(/C(/C1=O)=C(/c2ccccc2)\O)c(cccc2)c2F)C1=O
InChI	InChI=1S/C20H18FNO4/c21-15-10-5-4-9-14(15)17-16(18(24)13-7-2-1-3-8-13)19(25)20(26)22(17)11-6-12-23/h1-5,7-10,17,23-24H,6,11-12H2/t17-/m1/s1
InChIK	ROZNXTQZFJJRPD-QGZVFWFLSA-N
TotalMolweight	355.364
Molweight	355.364
MonoisotopicMass	355.121987
CLogP	1.9739
CLogS	-2.525
H Acceptors	5
H Donors	2
TotalSurfaceArea	261.07
Relative PSA	0.21385
PolarSurfaceArea	77.84
Druglikeness	-2.5013
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.46154
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	6
Symmetricatoms	2
Amides	1
StereoCon	racemate

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