
 OpenBabel04291915463D

 58 62  0  0  1  0  0  0  0  0999 V2000
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    6.6971   -3.7114    0.2898 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.5972   -1.1243    0.0983 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.3067    0.9546   -0.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8552    1.4045   -0.0911 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7968    2.9192   -0.2033 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1481   -1.2374    0.1047 C   0  0  3  0  0  0  0  0  0  0  0  0
    4.4747   -2.6790    0.2116 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5208   -3.5579    0.2760 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8070   -4.8213    0.3697 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0894   -5.2187    0.4001 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2534   -1.3559    0.1135 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5494   -2.6622    0.2105 C   0  0  0  0  0  0  0  0  0  0  0  0
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    6.0758   -4.3099    0.3336 C   0  0  0  0  0  0  0  0  0  0  0  0
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    3.4888   -3.4167    0.2643 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4752   -2.5080    0.1967 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1792   -1.2018    0.0986 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1656   -0.2930    0.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4480   -0.6904    0.0614 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2064   -3.0193    0.2338 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8473    1.1116   -0.0744 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6750    1.4749   -0.1023 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8731    2.0566   -0.1447 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5652    3.4149   -0.2467 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5517    4.3237   -0.3143 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2557    5.6299   -0.4123 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2421    6.5387   -0.4800 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9461    7.8449   -0.5780 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3250    3.7993   -0.2761 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.5115   -5.5877   -0.5499 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0491   -5.4810    1.1317 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7384   -5.4488    0.6864 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7977    1.2649   -0.9553 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7963    1.3939    0.7873 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3642    1.0941    0.8075 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3656    0.9652   -0.9350 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7582    3.5986    0.6225 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7403    3.8035   -0.8030 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2160   -1.7615    0.1427 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0114   -0.6574    0.0624 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7913   -3.3606    0.2616 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6264   -5.6808    0.4363 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1325   -4.0569    0.3165 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4606   -2.8134    0.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1937   -0.8963    0.0752 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4747   -0.5867    0.0542 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1796   -3.1231    0.2411 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8132    1.7652   -0.1224 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5371    4.0183   -0.2909 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2702    5.9353   -0.4357 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2276    6.2333   -0.4566 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1264    8.8582   -0.6539 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 36  1  0  0  0  0
  1 37  1  0  0  0  0
  1 38  1  0  0  0  0
  2  3  3  0  0  0  0
  3  4  1  0  0  0  0
  4  6  1  0  0  0  0
  4  5  2  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7 39  1  0  0  0  0
  7 40  1  0  0  0  0
  8  9  1  0  0  0  0
  8 41  1  0  0  0  0
  8 42  1  0  0  0  0
  9 10  1  0  0  0  0
  9 43  1  0  0  0  0
  9 44  1  0  0  0  0
 10 11  1  0  0  0  0
 10 45  1  0  0  0  0
 11 12  2  0  0  0  0
 11 15  1  0  0  0  0
 12 13  1  0  0  0  0
 13 21  1  0  0  0  0
 13 14  2  0  0  0  0
 14 19  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 16 46  1  0  0  0  0
 17 18  1  0  0  0  0
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 19 20  1  0  0  0  0
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 21 22  2  0  0  0  0
 21 26  1  0  0  0  0
 22 23  1  0  0  0  0
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 23 24  2  0  0  0  0
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 27 29  1  0  0  0  0
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 29 30  1  0  0  0  0
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 31 32  1  0  0  0  0
 31 55  1  0  0  0  0
 32 33  2  0  0  0  0
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 34 35  2  0  0  0  0
 34 58  1  0  0  0  0
M  END
>  <SKU>
A15824

>  <Product Name>
ACP-196 (Acalabrutinib)

>  <CAS>
1420477-60-6

>  <M.Wt>
465.50652

>  <Formula>
C26H23N7O2

>  <Synonyms>
Acalabrutinib, ACP196, ACP 196

>  <URL>
https://www.adooq.com/acp-196.html

$$$$
