SMILES:
OCc1cc(OCCCN2CCCCC2)no1Molecular Processing
Molecular formula
C12H20N2O3
Molecular weight
240.3
Exact mass
240.1474
XLogP
1.42
TPSA
58.73
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
62.83
Supplementary Information
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