이름: ethyl 3-cyclopropyl-3-(3-((N-(2′-fluoro-5′-methoxy-2-neopentyl-[1,1′-biphenyl]-4-yl)acetamido)methyl)phenyl)propanoate
SMILES:
CCOC(=O)CC(c1cccc(CN(C(C)=O)c2ccc(-c3cc(OC)ccc3F)c(CC(C)(C)C)c2)c1)C1CC1Molecular Processing
Molecular formula
C35H42FNO4
Molecular weight
559.72
Exact mass
559.3098
XLogP
8.09
TPSA
55.84
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
41
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
161.57
Supplementary Information
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