Molecule ID: 135498233

IUPAC Name: 2-amino-1H-purine-6,8-dione

Description: The molecule is an oxopurine that is guanine which is substituted by an oxo group at position 8. It is an oxopurine and a member of 2-aminopurines. It derives from a guanine.

SMILES: N=C1N=C(O)C2=NC(=O)NC2=N1

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

InChI: InChI=1S/C5H3N5O2/c6-4-8-2-1(3(11)10-4)7-5(12)9-2/h(H3,6,8,9,10,11,12)

Molecular Properties:
- Polar Surface Area: 109.0 Ų
- LogP: -1.3