SMILES:
CC(N)(C#N)COc1ccc(Cl)cc1Molecular Processing
Molecular formula
C10H11ClN2O
Molecular weight
210.66
Exact mass
210.056
XLogP
1.96
TPSA
59.04
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
55.15
Supplementary Information
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