SMILES:
CNCc1ccnc(C)c1Molecular Processing
Molecular formula
C8H12N2
Molecular weight
136.2
Exact mass
136.1
XLogP
1.11
TPSA
24.92
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
41.74
Supplementary Information
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