이름: Compound 5
SMILES:
CCOC(=O)c1ccc(Cl)nc1-c1ccc(F)cc1FMolecular Processing
Molecular formula
C14H10ClF2NO2
Molecular weight
297.69
Exact mass
297.0368
XLogP
3.86
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
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
0.143
Molar refractivity
70.56
Supplementary Information
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