이름: compound
SMILES:
COC(=O)c1c(C(C)C)nc(N)c(C=O)c1-c1ccc(F)cc1Molecular Processing
Molecular formula
C17H17FN2O3
Molecular weight
316.33
Exact mass
316.1223
XLogP
3.19
TPSA
82.28
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
84.86
Supplementary Information
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