Molecule ID: 135886616

IUPAC Name: 2-amino-6-(1-hydroxyethyl)-7-methyl-7,8-dihydro-3H-pteridin-4-one

Description: The molecule is a dihydropterin that is 7,8-dihydropteridin-4-one substituted at positions 2, 6 and 7 by amino, 1-hydroxyethyl and methyl groups respectively. It has a role as a bacterial metabolite. It is a dihydropterin, an aromatic amine and a secondary alcohol.

SMILES: CC(O)C1=Nc2c(O)nc(=N)[nH]c2NC1C

SELFIES: [C][C][Branch1][C][O][C][=N][C][C][Branch1][C][O][=N][C][=Branch1][C][=N][NH1][C][=Ring1][Branch2][N][C][Ring1][N][C]

InChI: InChI=1S/C9H13N5O2/c1-3-5(4(2)15)12-6-7(11-3)13-9(10)14-8(6)16/h3-4,15H,1-2H3,(H4,10,11,13,14,16)

Molecular Properties:
- Polar Surface Area: 112.0 Ų
- LogP: -1.2