
 OpenBabel04291915453D

 46 49  0  0  1  0  0  0  0  0999 V2000
    8.6342   -2.6332    2.1658 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8933   -3.6566    3.0108 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4793   -3.4685    2.8588 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.6497   -4.2388    3.4954 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3259   -4.0627    3.3531 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8601   -3.0902    2.5526 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6897   -2.3200    1.9161 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2392   -1.3795    1.1420 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1155   -5.2112    4.2958 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3957   -5.3815    4.4334 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0288   -2.5280    2.0847 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9512   -1.6717    1.3770 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5007   -0.7312    0.6028 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2739   -0.0134    0.0096 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8540    0.8631   -0.7119 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.2749   -1.8477    1.5192 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7594   -2.8590    2.3516 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4642   -4.8627    4.0143 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0970   -4.6809    3.8673 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3561   -5.7043    4.7123 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.1421   -5.5051    4.5513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8831   -6.5285    5.3963 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3813   -6.3292    5.2353 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0979   -7.3189    6.0525 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7368   -5.5263    6.1731 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6889   -2.7734    2.2791 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3691   -1.6472    2.4859 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3662   -2.7585    1.1375 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1613   -3.5313    4.0391 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1584   -4.6426    2.6907 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8429   -2.9549    2.4433 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8777   -0.6332    0.5277 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7298   -2.9881    2.4559 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1305   -3.4429    2.8341 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8290   -4.8062    2.8390 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8319   -3.6949    4.1874 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6212   -6.6903    4.3922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4101   -5.6303    3.5230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4073   -4.5191    4.8714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6151   -6.4032    6.4246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6180   -7.5144    5.0762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6493   -6.4545    4.2070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6465   -5.3432    5.5554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3192   -8.2504    5.7007 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8891   -4.5291    6.5298 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5860   -5.9060    6.7019 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 26  1  0  0  0  0
  1 27  1  0  0  0  0
  1 28  1  0  0  0  0
  2  3  1  0  0  0  0
  2 29  1  0  0  0  0
  2 30  1  0  0  0  0
  3  4  1  0  0  0  0
  3 11  1  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5 18  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 31  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 32  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 16  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 16 17  1  0  0  0  0
 17 33  1  0  0  0  0
 17 34  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 35  1  0  0  0  0
 19 36  1  0  0  0  0
 20 21  1  0  0  0  0
 20 25  1  0  0  0  0
 20 37  1  0  0  0  0
 21 22  1  0  0  0  0
 21 38  1  0  0  0  0
 21 39  1  0  0  0  0
 22 23  1  0  0  0  0
 22 40  1  0  0  0  0
 22 41  1  0  0  0  0
 23 24  1  0  0  0  0
 23 42  1  0  0  0  0
 23 43  1  0  0  0  0
 24 25  1  0  0  0  0
 24 44  1  0  0  0  0
 25 45  1  0  0  0  0
 25 46  1  0  0  0  0
M  END
>  <SKU>
A15226

>  <Product Name>
ROCK inhibitor-1

>  <CAS>
1415565-02-4

>  <M.Wt>
343.38364

>  <Formula>
C16H21N7O2

>  <Synonyms>
ROCK inhibitor1, ROCK inhibitor 1

>  <URL>
https://www.adooq.com/rock-inhibitor-1.html

$$$$
