-ISIS-  08091621332D

 15 16  0  0  0  0  0  0  0  0999 V2000
    0.1458    0.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0708    0.4958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2583    1.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7208    0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7333    1.2458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958   -1.1042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7208   -0.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2333    2.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4458   -0.6042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958    0.9083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4458    0.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5958   -2.1042    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3125   -1.1042    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.7208    1.1333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3083    1.9375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  5  2  1  0  0  0  0
  6  7  1  0  0  0  0
  7  4  2  0  0  0  0
  8  3  1  0  0  0  0
  9 11  1  0  0  0  0
 10  4  1  0  0  0  0
 11 10  2  0  0  0  0
 12  6  1  0  0  0  0
 13  9  1  0  0  0  0
 14  5  1  0  0  0  0
 15 14  1  0  0  0  0
  5  8  2  0  0  0  0
  9  6  2  0  0  0  0
M  END
>  <ID> (BBL000144)
BBL000144

>  <Rotatable_Bonds> (BBL000144)
3

>  <logP> (BBL000144)
2.995

>  <PSA> (BBL000144)
33.37

>  <H_Donors> (BBL000144)
1

>  <H_Acceptors> (BBL000144)
2

>  <Number_of_rings> (BBL000144)
2

>  <NAME> (BBL000144)
[5-(3,4-dichlorophenyl)furan-2-yl]methanol

>  <Mol_Weight> (BBL000144)
243.09

>  <Mol_Formula> (BBL000144)
C11H8Cl2O2

>  <Smiles> (BBL000144)
OCc1ccc(o1)c1ccc(c(c1)Cl)Cl

>  <Alternative_identifier> (BBL000144)
MFCD02257991

$$$$