N'-[3-(1,3-dioxoisoindol-2-yl)propanoyl]-4-nitrobenzohydrazide

Formula:C18H14N4O6 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-[3-(1,3-dioxoisoindol-2-yl)propanoyl]-4-nitrobenzohydrazide is a drug-like molecule.

MolName	N'-[3-(1,3-dioxoisoindol-2-yl)propanoyl]-4-nitrobenzohydrazide
MolecularFormula	C18H14N4O6
Smiles	[O-][N+](c(cc1)ccc1C(NNC(CCN(C(c1c2cccc1)=O)C2=O)=O)=O)=O
InChI	InChI=1S/C18H14N4O6/c23-15(19-20-16(24)11-5-7-12(8-6-11)22(27)28)9-10-21-17(25)13-3-1-2-4-14(13)18(21)26/h1-8H,9-10H2,(H,19,23)(H,20,24)
InChIK	YKVHVYURKSVJQX-UHFFFAOYSA-N
TotalMolweight	382.331
Molweight	382.331
MonoisotopicMass	382.091336
CLogP	0.1293
CLogS	-3.811
H Acceptors	10
H Donors	2
TotalSurfaceArea	274.93
Relative PSA	0.39665
PolarSurfaceArea	141.4
Druglikeness	-0.73583
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.60714
Fragments	1
Non HAtoms	28
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	6
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	3
Symmetricatoms	7
Amides	1
AcidicOxygens	1
StereoCon

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