SMILES:
COc1ccc(C=C2CCCCC2NCCCO)cc1Molecular Processing
Molecular formula
C17H25NO2
Molecular weight
275.39
Exact mass
275.1885
XLogP
2.99
TPSA
41.49
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
82.93
Supplementary Information
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