SMILES:
NCc1ccncn1Molecular Processing
Molecular formula
C5H7N3
Molecular weight
109.13
Exact mass
109.064
XLogP
-0.06
TPSA
51.8
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
29.92
Supplementary Information
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