-ISIS-  08091621332D

 21 22  0  0  0  0  0  0  0  0999 V2000
   -1.5583    0.1750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1833   -1.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5875   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4458   -1.3167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7083    0.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1958   -2.3042    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9958    0.3833    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7125   -1.3292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3083   -0.8042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1583    0.1625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0375   -0.7875    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0458    0.6458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1708   -0.8375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4208    0.6708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7208    1.0833    0.0000 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.4208    1.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1958    2.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5458    1.4833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1458    1.8583    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4583    1.3458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0375    2.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  9  1  0  0  0  0
  3  1  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
  6  2  2  0  0  0  0
  7 12  1  0  0  0  0
  8  3  1  0  0  0  0
  9  4  1  0  0  0  0
 10  5  2  0  0  0  0
 11  2  1  0  0  0  0
 12 10  1  0  0  0  0
 13 10  1  0  0  0  0
 14  1  1  0  0  0  0
 15  7  1  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18 15  1  0  0  0  0
 19 17  1  0  0  0  0
 20 18  1  0  0  0  0
 21 20  1  0  0  0  0
 13  8  2  0  0  0  0
 19 21  1  0  0  0  0
M  END
>  <ID> (BBL000021)
BBL000021

>  <Rotatable_Bonds> (BBL000021)
7

>  <logP> (BBL000021)
1.941

>  <PSA> (BBL000021)
73.58

>  <H_Donors> (BBL000021)
3

>  <H_Acceptors> (BBL000021)
3

>  <Number_of_rings> (BBL000021)
2

>  <NAME> (BBL000021)
2-{4-[(cyclohexylamino)methyl]-2-methoxyphenoxy}acetamide

>  <Mol_Weight> (BBL000021)
292.38

>  <Mol_Formula> (BBL000021)
C16H24N2O3

>  <Smiles> (BBL000021)
COc1cc(CNC2CCCCC2)ccc1OCC(=O)N

>  <CAS_Number> (BBL000021)
425646-58-8

>  <Alternative_identifier> (BBL000021)
MFCD02916893

$$$$