-ISIS-  04261722012D

 14 16  0  0  0  0  0  0  0  0999 V2000
    0.6292   -0.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3042    0.3708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2458    0.2208    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6792    1.0708    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1542    1.3125    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6292   -1.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0042    1.7458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0292   -0.3000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2042   -1.7417    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0333   -1.2625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8583    0.1708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8583   -1.7417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6833   -0.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6833   -1.2625    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  2  0  0  0  0
  5  2  2  0  0  0  0
  6  1  2  0  0  0  0
  7  5  1  0  0  0  0
  8  1  1  0  0  0  0
  9  6  1  0  0  0  0
 10  8  2  0  0  0  0
 11  8  1  0  0  0  0
 12 10  1  0  0  0  0
 13 11  2  0  0  0  0
 14 12  2  0  0  0  0
  9 10  1  0  0  0  0
  7  4  1  0  0  0  0
 14 13  1  0  0  0  0
M  END
>  <ID> (STL503512)
STL503512

>  <Rotatable_Bonds> (STL503512)
0

>  <logP> (STL503512)
1.574

>  <PSA> (STL503512)
70.25

>  <H_Donors> (STL503512)
2

>  <H_Acceptors> (STL503512)
0

>  <Number_of_rings> (STL503512)
3

>  <Compound_Names> (STL503512)
3-(2H-tetrazol-5-yl)-1H-indole

>  <Mol_Weight> (STL503512)
185.19

>  <Mol_Formula> (STL503512)
C9H7N5

>  <Smiles> (STL503512)
n1[nH]nc(n1)c1c[nH]c2c1cccc2

$$$$