N'-(3-morpholin-4-ium-4-ylpropanoyl)-2,4-dinitrobenzohydrazide

Formula:C14H18N5O7 Mutagenic:none Tumorigenic:none Reproductive Effective:none N'-(3-morpholin-4-ium-4-ylpropanoyl)-2,4-dinitrobenzohydrazide is not a drug-like molecule.

MolName	N'-(3-morpholin-4-ium-4-ylpropanoyl)-2,4-dinitrobenzohydrazide
MolecularFormula	C14H18N5O7
Smiles	[O-][N+](c(cc1)cc([N+]([O-])=O)c1C(NNC(CC[NH+]1CCOCC1)=O)=O)=O
InChI	InChI=1S/C14H17N5O7/c20-13(3-4-17-5-7-26-8-6-17)15-16-14(21)11-2-1-10(18(22)23)9-12(11)19(24)25/h1-2,9H,3-8H2,(H,15,20)(H,16,21)/p+1
InChIK	CIBIOVALEVZLAW-UHFFFAOYSA-O
TotalMolweight	368.325
Molweight	368.325
MonoisotopicMass	368.120625
CLogP	-2.7474
CLogS	-2.52
H Acceptors	12
H Donors	3
TotalSurfaceArea	282.42
Relative PSA	0.48662
PolarSurfaceArea	163.51
Druglikeness	-5.2822
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.61538
Fragments	1
Non HAtoms	26
NonCHAtoms	12
Electronegative Atoms	12
Rotatable Bond	7
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	10
Symmetricatoms	2
Amines	1
AlkylAmines	1
BasicNitrogens	1
AcidicOxygens	2
StereoCon

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