-ISIS-  08091621332D

 17 19  0  0  0  0  0  0  0  0999 V2000
    0.5792   -1.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5750   -1.1083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3750   -0.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9792   -0.2042    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4958    0.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0792   -1.9792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3583   -0.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0792   -1.9792    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4958    1.4833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    1.4833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3750    1.9833    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2208    0.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3583   -1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0833   -0.0250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2208   -1.5292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0833   -1.0292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  2  1  0  0  0  0
  5  3  1  0  0  0  0
  6  3  2  0  0  0  0
  7  2  1  0  0  0  0
  8  6  1  0  0  0  0
  9  7  1  0  0  0  0
 10  6  1  0  0  0  0
 11  5  2  0  0  0  0
 12 10  2  0  0  0  0
 13  8  2  0  0  0  0
 14  8  1  0  0  0  0
 15 13  1  0  0  0  0
 16 14  2  0  0  0  0
 17 16  1  0  0  0  0
  5  4  1  0  0  0  0
 12 11  1  0  0  0  0
 17 15  2  0  0  0  0
M  END
>  <ID> (BBL000389)
BBL000389

>  <Rotatable_Bonds> (BBL000389)
0

>  <logP> (BBL000389)
3.47

>  <PSA> (BBL000389)
79.18

>  <H_Donors> (BBL000389)
3

>  <H_Acceptors> (BBL000389)
0

>  <Number_of_rings> (BBL000389)
3

>  <NAME> (BBL000389)
2-hydrazinyl-4-phenyl-1,3-benzothiazole

>  <Mol_Weight> (BBL000389)
241.32

>  <Mol_Formula> (BBL000389)
C13H11N3S

>  <Smiles> (BBL000389)
NNc1sc2c(n1)c(ccc2)c1ccccc1

>  <Alternative_identifier> (BBL000389)
MFCD11557500

$$$$