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

Formula:C14H13N5O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide is a drug-like molecule.

MolName	2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
MolecularFormula	C14H13N5O3
Smiles	O=C(CC(C(N1)=O)=NNC1=O)N/N=C\C=C\c1ccccc1
InChI	InChI=1S/C14H13N5O3/c20-12(9-11-13(21)16-14(22)19-17-11)18-15-8-4-7-10-5-2-1-3-6-10/h1-8H,9H2,(H,18,20)(H2,16,19,21,22)
InChIK	NWROYOQUAYLGCL-UHFFFAOYSA-N
TotalMolweight	299.289
Molweight	299.289
MonoisotopicMass	299.10184
CLogP	0.4919
CLogS	-3.653
H Acceptors	8
H Donors	3
TotalSurfaceArea	235.38
Relative PSA	0.41006
PolarSurfaceArea	112.02
Druglikeness	7.0982
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.72727
Fragments	1
Non HAtoms	22
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	1
Symmetricatoms	2
Amides	1
StereoCon

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

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