Molecule ID: 30976

IUPAC Name: 7H-purine-2,6-diamine

Description: The molecule is a member of the class of 2,6-diaminopurines that is 9H-purine in which the hydrogens at positions 2 and 6 are replaced by amino groups. It has a role as an antineoplastic agent. It is a primary amino compound and a member of 2,6-diaminopurines. It derives from an adenine.

SMILES: N=c1[nH]c2ncnc-2c(N)[nH]1

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

InChI: InChI=1S/C5H6N6/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H5,6,7,8,9,10,11)

Molecular Properties:
- Polar Surface Area: 107.0 Ų
- LogP: -0.9