SMILES:
CNC(=NCCNCc1ncccn1)NC#NMolecular Processing
Molecular formula
C10H15N7
Molecular weight
233.28
Exact mass
233.1389
XLogP
-0.79
TPSA
98.02
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
17
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
63.85
Supplementary Information
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