SMILES:
Fc1ccc(-c2nc3n(c2Br)CCC3)cc1Molecular Processing
Molecular formula
C12H10BrFN2
Molecular weight
281.13
Exact mass
280.0011
XLogP
3.4
TPSA
17.82
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
16
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
63.64
Supplementary Information
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