이름: 3-cyclopropyl-3-(3-(((2-(2,2-dimethylpropyl)-2′-fluoro-5′-methoxybiphenyl-4-yl)oxy)methyl)phenyl)propanoic acid
SMILES:
COc1ccc(F)c(-c2ccc(OCc3cccc(C(CC(=O)O)C4CC4)c3)cc2CC(C)(C)C)c1Molecular Processing
Molecular formula
C31H35FO4
Molecular weight
490.62
Exact mass
490.2519
XLogP
7.64
TPSA
55.76
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
10
Heavy atoms
36
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.387
Molar refractivity
140.04
Supplementary Information
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