الاسم: 3-(4,4-dimethylpentyl)-2′-fluoro-5′-methoxy-[1,1′-biphenyl]-4-ol
SMILES:
COc1ccc(F)c(-c2ccc(O)c(CCCC(C)(C)C)c2)c1Molecular Processing
Molecular formula
C20H25FO2
Molecular weight
316.42
Exact mass
316.1839
XLogP
5.58
TPSA
29.46
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
23
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
0.4
Molar refractivity
92.45
Supplementary Information
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