3-morpholin-4-ium-4-yl-N'-[(E)-3-(3-nitrophenyl)prop-2-enoyl]propanehydrazide

Formula:C16H21N4O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none 3-morpholin-4-ium-4-yl-N'-[(E)-3-(3-nitrophenyl)prop-2-enoyl]propanehydrazide is a drug-like molecule.

MolName	3-morpholin-4-ium-4-yl-N'-[(E)-3-(3-nitrophenyl)prop-2-enoyl]propanehydrazide
MolecularFormula	C16H21N4O5
Smiles	[O-][N+](c1cc(/C=C/C(NNC(CC[NH+]2CCOCC2)=O)=O)ccc1)=O
InChI	InChI=1S/C16H20N4O5/c21-15(5-4-13-2-1-3-14(12-13)20(23)24)17-18-16(22)6-7-19-8-10-25-11-9-19/h1-5,12H,6-11H2,(H,17,21)(H,18,22)/p+1
InChIK	OBMNMPNPSWWRAD-UHFFFAOYSA-O
TotalMolweight	349.366
Molweight	349.366
MonoisotopicMass	349.151196
CLogP	-1.4966
CLogS	-2.43
H Acceptors	9
H Donors	3
TotalSurfaceArea	285.25
Relative PSA	0.37514
PolarSurfaceArea	117.69
Druglikeness	-6.2465
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.68
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	9
Symmetricatoms	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
AcidicOxygens	1
StereoCon

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