이름: 3-[(6-(3-cyanophenoxy)-3,5-difluoro-4-methylpyridin-2-yl)oxy]benzene-propionicacid
SMILES:
Cc1c(F)c(Oc2cccc(C#N)c2)nc(Oc2cccc(CCC(=O)O)c2)c1FMolecular Processing
Molecular formula
C22H16F2N2O4
Molecular weight
410.38
Exact mass
410.1078
XLogP
5.14
TPSA
92.44
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.136
Molar refractivity
102.59
Supplementary Information
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