SMILES:
COCOc1ccc2c(c1)c(CO)c(C(C)C)n2Cc1ccccc1Molecular Processing
Molecular formula
C21H25NO3
Molecular weight
339.44
Exact mass
339.1834
XLogP
4.29
TPSA
43.62
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
25
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
0.333
Molar refractivity
100
Supplementary Information
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