SMILES:
Cc1noc(-c2ccc(Br)cc2)c1C=OMolecular Processing
Molecular formula
C11H8BrNO2
Molecular weight
266.09
Exact mass
264.9738
XLogP
3.23
TPSA
43.1
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
59.76
Supplementary Information
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