이름: 3-[3-fluoro-4-(4-oxo-3,4-dihydro-2H-pyridin-1-yl)phenylamino]-2(R)-hydroxypropionic acid ethyl ester
SMILES:
CCOC(=O)[C@H](O)CNc1ccc(N2C=CC(=O)CC2)c(F)c1Molecular Processing
Molecular formula
C16H19FN2O4
Molecular weight
322.34
Exact mass
322.1329
XLogP
1.45
TPSA
78.87
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
83.64
Supplementary Information
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