SMILES:
Cc1cc(Oc2ccc(F)cc2F)c(Br)cc1NMolecular Processing
Molecular formula
C13H10BrF2NO
Molecular weight
314.13
Exact mass
312.9914
XLogP
4.41
TPSA
35.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
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
0.077
Molar refractivity
69.72
Supplementary Information
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