N-[(Z)-(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide

Formula:C11H12N8O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide is not a drug-like molecule.

MolName	N-[(Z)-(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]-3-[(3,5-dioxo-2H-1,2,4-triazin-6-yl)amino]propanamide
MolecularFormula	C11H12N8O5
Smiles	O=C(CCNC(C(N1)=O)=NNC1=O)N/N=C\C(NC(N1)=O)=CC1=O
InChI	InChI=1S/C11H12N8O5/c20-6(1-2-12-8-9(22)16-11(24)19-18-8)17-13-4-5-3-7(21)15-10(23)14-5/h3-4H,1-2H2,(H,12,18)(H,17,20)(H2,14,15,21,23)(H2,16,19,22,24)
InChIK	JYHHOMYWYIOTDC-UHFFFAOYSA-N
TotalMolweight	336.267
Molweight	336.267
MonoisotopicMass	336.093067
CLogP	-3.305
CLogS	-2.482
H Acceptors	13
H Donors	6
TotalSurfaceArea	243.97
Relative PSA	0.64344
PolarSurfaceArea	182.25
Druglikeness	5.8368
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.66667
Fragments	1
Non HAtoms	24
NonCHAtoms	13
Electronegative Atoms	13
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Sp3Atoms	2
Amides	3
StereoCon

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

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