Name: compound
SMILES:
CCC(N)(C#N)c1ccccc1Molecular Processing
Molecular formula
C10H12N2
Molecular weight
160.22
Exact mass
160.1
XLogP
1.77
TPSA
49.81
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
48.21
Supplementary Information
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