SMILES:
O=C1Nc2cc(CCCO)ccc2C2CCCC12Molecular Processing
Molecular formula
C15H19NO2
Molecular weight
245.32
Exact mass
245.1416
XLogP
2.45
TPSA
49.33
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
70.56
Supplementary Information
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