2-(2-fluorophenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one

Formula:C21H18NO4F Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(2-fluorophenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one is a drug-like molecule.

MolName	2-(2-fluorophenyl)-4-hydroxy-1-(2-hydroxyethyl)-3-[(E)-3-phenylprop-2-enoyl]-2H-pyrrol-5-one
MolecularFormula	C21H18NO4F
Smiles	OCCN(C(C(C(/C=C/c1ccccc1)=O)=C1O)c(cccc2)c2F)C1=O
InChI	InChI=1S/C21H18FNO4/c22-16-9-5-4-8-15(16)19-18(20(26)21(27)23(19)12-13-24)17(25)11-10-14-6-2-1-3-7-14/h1-11,19,24,26H,12-13H2/t19-/m1/s1
InChIK	QIVQKIVBIHNKRV-LJQANCHMSA-N
TotalMolweight	367.375
Molweight	367.375
MonoisotopicMass	367.121987
CLogP	2.0252
CLogS	-2.965
H Acceptors	5
H Donors	2
TotalSurfaceArea	273.81
Relative PSA	0.2039
PolarSurfaceArea	77.84
Druglikeness	3.3351
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	limit! 4-acyl-3-azoline-2-one-3-ol
Shape Index	0.48148
Fragments	1
Non HAtoms	27
NonCHAtoms	6
Electronegative Atoms	6
StereoCenters	1
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	2
Amides	1
StereoCon	racemate

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