Chem 5 Nitrouracil 2 Sajjan | Cheminformatics
2D Structure

5-Nitrouracil


  • SKU Code: CH139713
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Chemical Name - 5-Nitrouracil
Mol Weight - 157.085
Smiles - [O-][N+](C(C(N1)=O)=CNC1=O)=O
Property Name Property Value
Mol Name5-Nitrouracil
Molweight157.085
Monoisotopic Mass157.012357
Clogp-2.1461
Clogs-1.61
H Acceptors7
H Donors2
Total Surface Area106.8
Relative Psa0.74363
Polar Surface Area104.02
Druglikeness-3.2275
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.63636
Molecular Flexibility0.36033
Molecular Complexity0.75684
Fragments1
Non H Atoms11
Non Ch Atoms7
Electronegative Atoms7
Rotatable Bonds1
Rings Closures1
Small Rings1
Sp3 Atoms1
Amides2
Acidic Oxygens1
Smiles[O-][N+](C(C(N1)=O)=CNC1=O)=O
InChIKeyInChI=1S/C4H3N3O4/c8-3-2(7(10)11)1-5-4(9)6-3/h1H,(H2,5,6,8,9)
InChITUARVSWVPPVUGS-UHFFFAOYSA-N

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