N'-[(3R)-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]-4-nitrobenzohydrazide

Formula:C18H13N4O5F3 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[(3R)-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]-4-nitrobenzohydrazide is a drug-like molecule.

MolName	N'-[(3R)-2,5-dioxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl]-4-nitrobenzohydrazide
MolecularFormula	C18H13N4O5F3
Smiles	[O-][N+](c(cc1)ccc1C(NN[C@H](CC(N1c2cccc(C(F)(F)F)c2)=O)C1=O)=O)=O
InChI	InChI=1S/C18H13F3N4O5/c19-18(20,21)11-2-1-3-13(8-11)24-15(26)9-14(17(24)28)22-23-16(27)10-4-6-12(7-5-10)25(29)30/h1-8,14,22H,9H2,(H,23,27)/t14-/m0/s1
InChIK	YYQNLKONDVSNMG-AWEZNQCLSA-N
TotalMolweight	422.318
Molweight	422.318
MonoisotopicMass	422.083805
CLogP	0.5657
CLogS	-4.822
H Acceptors	9
H Donors	2
TotalSurfaceArea	285.38
Relative PSA	0.33643
PolarSurfaceArea	124.33
Druglikeness	-7.5076
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.56667
Fragments	1
Non HAtoms	30
NonCHAtoms	12
Electronegative Atoms	12
StereoCenters	1
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	5
Symmetricatoms	4
Amides	1
AcidicOxygens	1
StereoCon	this enantiomer

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