SMILES:
CCCC(CCC)CCCC1COCCN1Cc1ccccc1Molecular Processing
Molecular formula
C21H35NO
Molecular weight
317.52
Exact mass
317.2719
XLogP
5.27
TPSA
12.47
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
10
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
98.62
Supplementary Information
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