N-[(Z)-1-amino-3-hydrazinyl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide

Formula:C16H15N5O4 Mutagenic:none Tumorigenic:high Reproductive Effective:none N-[(Z)-1-amino-3-hydrazinyl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide is a drug-like molecule.

MolName	N-[(Z)-1-amino-3-hydrazinyl-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C16H15N5O4
Smiles	N/C(/c1cccc([N+]([O-])=O)c1)=C(/C(NN)=O)\NC(c1ccccc1)=O
InChI	InChI=1S/C16H15N5O4/c17-13(11-7-4-8-12(9-11)21(24)25)14(16(23)20-18)19-15(22)10-5-2-1-3-6-10/h1-9H,17-18H2,(H,19,22)(H,20,23)
InChIK	DMAKTCPTTKQRGI-UHFFFAOYSA-N
TotalMolweight	341.326
Molweight	341.326
MonoisotopicMass	341.112405
CLogP	-0.425
CLogS	-3.796
H Acceptors	9
H Donors	4
TotalSurfaceArea	255.07
Relative PSA	0.4311
PolarSurfaceArea	156.06
Druglikeness	-8.0991
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro; hydrazine
Shape Index	0.52
Fragments	1
Non HAtoms	25
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	2
Symmetricatoms	2
Amides	1
AcidicOxygens	1
StereoCon

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