SMILES:
OB(O)c1cc(F)ncc1ClMolecular Processing
Molecular formula
C5H4BClFNO2
Molecular weight
175.35
Exact mass
175.0008
XLogP
-0.45
TPSA
53.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.03
Supplementary Information
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