Molecule ID: 57517139

IUPAC Name: diaminomethylidene-[(E)-[(1E)-1-(diaminomethylideneamino)azaniumylidenepropan-2-ylidene]amino]azanium

Description: The molecule is a guanidinium ion obtained by protonation of the two imino nitrogens of mitoguazone; major species at pH 7.3. It is a conjugate acid of a mitoguazone.

SMILES: CC(/C=N/NC(=[NH2+])[NH3+])=N\NC(=N)N

SELFIES: [C][C][Branch1][=Branch2][/C][=N][/N][C][=Branch1][C][=NH2+1][NH3+1][=N][\N][C][=Branch1][C][=N][N]

InChI: InChI=1S/C5H12N8/c1-3(11-13-5(8)9)2-10-12-4(6)7/h2H,1H3,(H4,6,7,12)(H4,8,9,13)/p+2/b10-2+,11-3+

Molecular Properties:
- Polar Surface Area: 157.0 Ų
- LogP: -2.2