-ISIS-  04261722012D

 14 15  0  0  0  0  0  0  0  0999 V2000
    0.7750   -0.6875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2292   -0.6875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7333    0.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7333    0.1708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2833    0.1833    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2833   -1.5583    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.2458    1.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7500    1.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2542    1.0417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2500    2.7792    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -0.7458    1.9167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9917   -2.7750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0458   -2.5167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2458   -1.7958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  1  0  0  0  0
  5  1  2  0  0  0  0
  6  1  1  0  0  0  0
  7  4  2  0  0  0  0
  8 11  2  0  0  0  0
  9  3  2  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12 14  1  0  0  0  0
 13  6  1  0  0  0  0
 14  6  1  0  0  0  0
 12 13  1  0  0  0  0
  8  7  1  0  0  0  0
M  END
>  <ID> (STL504061)
STL504061

>  <Rotatable_Bonds> (STL504061)
1

>  <logP> (STL504061)
2.85

>  <PSA> (STL504061)
41.99

>  <H_Donors> (STL504061)
1

>  <H_Acceptors> (STL504061)
1

>  <Number_of_rings> (STL504061)
2

>  <Compound_Names> (STL504061)
N-(5-bromopyridin-2-yl)cyclobutanecarboxamide

>  <Mol_Weight> (STL504061)
255.11

>  <Mol_Formula> (STL504061)
C10H11BrN2O

>  <Smiles> (STL504061)
O=C(C1CCC1)Nc1ccc(cn1)Br

$$$$