Molecule ID: 5246682

IUPAC Name: 1,3,5-triazin-1-ium-2,4,6-triamine

Description: The molecule is an organic cation obtained by protonation of one of the three ring nitrogens of melamine. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.). It has a role as a xenobiotic metabolite. It is a conjugate acid of a melamine.

SMILES: N=c1[nH]c(=N)[nH]c(=[NH2+])[nH]1

SELFIES: [N][=C][NH1][C][=Branch1][C][=N][NH1][C][=Branch1][C][=NH2+1][NH1][Ring1][Branch2]

InChI: InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)/p+1

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -0.9