2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]acetamide

Formula:C14H16N6O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]acetamide is a drug-like molecule.

MolName	2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]acetamide
MolecularFormula	C14H16N6O3
Smiles	O=C(CNC(C(N1)=O)=NNC1=O)N/N=C\CCc1ccccc1
InChI	InChI=1S/C14H16N6O3/c21-11(9-15-12-13(22)17-14(23)20-19-12)18-16-8-4-7-10-5-2-1-3-6-10/h1-3,5-6,8H,4,7,9H2,(H,15,19)(H,18,21)(H2,17,20,22,23)
InChIK	COJAZYNYJCSJKR-UHFFFAOYSA-N
TotalMolweight	316.32
Molweight	316.32
MonoisotopicMass	316.128389
CLogP	-0.5138
CLogS	-3.093
H Acceptors	9
H Donors	4
TotalSurfaceArea	247.86
Relative PSA	0.43565
PolarSurfaceArea	124.05
Druglikeness	5.6889
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.73913
Fragments	1
Non HAtoms	23
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	3
Symmetricatoms	2
Amides	1
StereoCon

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1 - 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]acetamide | 2 - 2-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]-N-[(Z)-3-phenylpropylideneamino]acetamide

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