SMILES:
N#Cc1ccc(-c2ccc(OCCCCCCCCO)cc2)cc1Molecular Processing
Molecular formula
C21H25NO2
Molecular weight
323.44
Exact mass
323.1885
XLogP
4.94
TPSA
53.25
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
24
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.381
Molar refractivity
96.88
Supplementary Information
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