Molecule ID: 70269

IUPAC Name: 6-methyl-2H-1,2,4-triazine-3,5-dione

Description: The molecule is a nucleobase analogue that is thymine in which the CH group at position 6 is replaced by nitrogen. It has a role as a Mycoplasma genitalium metabolite and an EC 2.6.1.40 [(R)-3-amino-2-methylpropionate--pyruvate transaminase] inhibitor. It is a cyclic ketone, a member of 1,2,4-triazines and a nucleobase analogue.

SMILES: Cc1nnc(O)nc1O

SELFIES: [C][C][=N][N][=C][Branch1][C][O][N][=C][Ring1][#Branch1][O]

InChI: InChI=1S/C4H5N3O2/c1-2-3(8)5-4(9)7-6-2/h1H3,(H2,5,7,8,9)

Molecular Properties:
- Polar Surface Area: 70.6 Ų
- LogP: -0.3