Molecule ID: 126569

IUPAC Name: (2S)-2-amino-3-(5-fluoro-2,4-dioxopyrimidin-1-yl)propanoic acid

Description: The molecule is an alanine derivative that is L-alanine bearing a 5-fluorouracil-1-yl substituent at position 3. A more potent and selective AMPA receptor agonist (at hGluR1 and hGluR2) than AMPA itself (Ki = 14.7, 25.1, and 1820 nM for hGluR1, hGluR2 and hGluR5 respectively). It has a role as an AMPA receptor agonist. It is an organofluorine compound, a non-proteinogenic L-alpha-amino acid and a L-alanine derivative. It derives from a uracil.

SMILES: N[C@@H](Cn1cc(F)c(O)nc1=O)C(=O)O

SELFIES: [N][C@@H1][Branch1][P][C][N][C][=C][Branch1][C][F][C][Branch1][C][O][=N][C][Ring1][Branch2][=O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C7H8FN3O4/c8-3-1-11(2-4(9)6(13)14)7(15)10-5(3)12/h1,4H,2,9H2,(H,13,14)(H,10,12,15)/t4-/m0/s1

Molecular Properties:
- Polar Surface Area: 113.0 Ų
- LogP: -4.4