SMILES:
COC(=O)c1c(C(C)C)n(Cc2ccccc2)c2ccc(O)cc12Molecular Processing
Molecular formula
C20H21NO3
Molecular weight
323.39
Exact mass
323.1521
XLogP
4.31
TPSA
51.46
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
94.58
Supplementary Information
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