Nc1n[nH]c2cc(Br)cc(F)c12
SMILES: Nc1n[nH]c2cc(Br)cc(F)c12

Molecular Processing

Molecular formula
C7H5BrFN3
Molecular weight
230.04
Exact mass
228.9651
XLogP
2.05
TPSA
54.7
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
48.16

Supplementary Information

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