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

Formula:C10H9N7O5 Mutagenic:none Tumorigenic:none Reproductive Effective:none N-[(Z)-(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]-2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)acetamide is not a drug-like molecule.

MolNameN-[(Z)-(2,4-dioxo-1H-pyrimidin-6-yl)methylideneamino]-2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)acetamide
MolecularFormulaC10H9N7O5
SmilesO=C(CC(C(N1)=O)=NNC1=O)N/N=C\C(NC(N1)=O)=CC1=O
InChIInChI=1S/C10H9N7O5/c18-6-1-4(12-9(21)13-6)3-11-16-7(19)2-5-8(20)14-10(22)17-15-5/h1,3H,2H2,(H,16,19)(H2,12,13,18,21)(H2,14,17,20,22)
InChIKBQMCIRVGTJAVQO-UHFFFAOYSA-N
TotalMolweight307.225
Molweight307.225
MonoisotopicMass307.066518
CLogP-2.6304
CLogS-2.637
H Acceptors12
H Donors5
TotalSurfaceArea218.75
Relative PSA0.66523
PolarSurfaceArea170.22
Druglikeness5.9471
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.63636
Fragments1
Non HAtoms22
NonCHAtoms12
Electronegative Atoms12
Rotatable Bond4
Rings Closures2
Small Rings2
Sp3Atoms1
Amides3
StereoCon

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