SMILES:
CCCCOc1ccccc1NCC1OC(C)C(C)O1Molecular Processing
Molecular formula
C16H25NO3
Molecular weight
279.38
Exact mass
279.1834
XLogP
3.43
TPSA
39.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
80.22
Supplementary Information
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