N-[(Z)-1-(4-bromophenyl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]-2-fluorobenzamide

Formula:C20H18N2O2BrF Mutagenic:none Tumorigenic:none Reproductive Effective:low N-[(Z)-1-(4-bromophenyl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]-2-fluorobenzamide is a drug-like molecule.

MolName	N-[(Z)-1-(4-bromophenyl)-3-oxo-3-pyrrolidin-1-ylprop-1-en-2-yl]-2-fluorobenzamide
MolecularFormula	C20H18N2O2BrF
Smiles	O=C(/C(/NC(c(cccc1)c1F)=O)=C/c(cc1)ccc1Br)N1CCCC1
InChI	InChI=1S/C20H18BrFN2O2/c21-15-9-7-14(8-10-15)13-18(20(26)24-11-3-4-12-24)23-19(25)16-5-1-2-6-17(16)22/h1-2,5-10,13H,3-4,11-12H2,(H,23,25)
InChIK	MRWIXRGKPDWRDG-UHFFFAOYSA-N
TotalMolweight	417.277
Molweight	417.277
MonoisotopicMass	416.053567
CLogP	4.5986
CLogS	-4.838
H Acceptors	4
H Donors	1
TotalSurfaceArea	281.51
Relative PSA	0.14596
PolarSurfaceArea	49.41
Druglikeness	2.5181
Mutagenic	none
Tumorigenic	none
Reproductive Effective	low
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	26
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	4
Symmetricatoms	4
Amides	2
StereoCon

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