
 OpenBabel04291915403D

 50 53  0  0  0  0  0  0  0  0999 V2000
    4.9496   -7.4200    1.9175 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4694   -7.3989    1.9107 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9552   -6.0042    1.5512 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4370   -5.9836    1.5447 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0915   -4.8481    1.2518 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4343   -4.8295    1.2458 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0888   -3.6940    0.9529 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4231   -2.6139    0.6754 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.1245   -2.6319    0.6812 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4588   -1.5518    0.4037 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.1226   -5.9463    1.5328 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2817   -7.3541    1.8968 S   0  0  0  0  0  0  0  0  0  0  0  0
   12.4851   -3.6746    0.9467 N   0  0  0  0  0  0  0  0  0  0  0  0
   13.1842   -2.4617    0.6339 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.6825   -2.7100    0.6965 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.3816   -1.4970    0.3836 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.6464   -0.3040    0.0771 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.2203   -4.8677    1.2532 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7780   -1.4777    0.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3973   -0.4032    0.1003 N   0  0  0  0  0  0  0  0  0  0  0  0
   18.8316   -0.3833    0.0939 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.3174    1.0115   -0.2656 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.6862   -2.9514    0.7560 S   0  0  0  0  0  0  0  0  0  0  0  0
   18.8014    2.0077    0.7599 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.8372    1.0325   -0.2723 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6076   -8.4018    2.1705 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5849   -7.1543    0.9472 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5863   -6.7187    2.6394 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8327   -8.1002    1.1888 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8341   -7.6645    2.8809 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5919   -5.3029    2.2731 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5905   -5.7385    0.5810 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5626   -3.9899    1.0313 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6215   -3.5045    0.9063 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9183   -1.7042    1.3412 H   0  0  0  0  0  0  0  0  0  0  0  0
   12.9169   -2.1398   -0.3509 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9484   -3.4675   -0.0109 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.9499   -3.0319    1.6813 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5704    0.0720   -0.9218 H   0  0  0  0  0  0  0  0  0  0  0  0
   14.5376    0.7032    0.4214 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.2949   -5.6793    0.5600 H   0  0  0  0  0  0  0  0  0  0  0  0
   13.3300   -5.5835    2.0410 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1949   -1.0845   -0.6280 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1963   -0.6489    1.0641 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1835    2.9815    0.5348 H   0  0  0  0  0  0  0  0  0  0  0  0
   19.1255    1.7144    1.7366 H   0  0  0  0  0  0  0  0  0  0  0  0
   17.7320    2.0285    0.7303 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.1792    2.0143   -0.5254 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.2005    0.3312   -0.9942 H   0  0  0  0  0  0  0  0  0  0  0  0
   21.2019    0.7669    0.6979 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 31  1  0  0  0  0
  3 32  1  0  0  0  0
  4  5  2  0  0  0  0
  4 12  1  0  0  0  0
  5  6  1  0  0  0  0
  5 33  1  0  0  0  0
  6  7  2  0  0  0  0
  6 11  1  0  0  0  0
  7 13  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
  9 34  1  0  0  0  0
 10 11  2  0  0  0  0
 11 12  1  0  0  0  0
 13 14  1  0  0  0  0
 13 18  1  0  0  0  0
 14 15  1  0  0  0  0
 14 35  1  0  0  0  0
 14 36  1  0  0  0  0
 15 16  1  0  0  0  0
 15 37  1  0  0  0  0
 15 38  1  0  0  0  0
 16 19  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 39  1  0  0  0  0
 17 40  1  0  0  0  0
 18 41  1  0  0  0  0
 18 42  1  0  0  0  0
 19 20  2  0  0  0  0
 19 23  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 21 43  1  0  0  0  0
 21 44  1  0  0  0  0
 22 25  1  0  0  0  0
 22 24  1  0  0  0  0
 22 23  1  0  0  0  0
 24 45  1  0  0  0  0
 24 46  1  0  0  0  0
 24 47  1  0  0  0  0
 25 48  1  0  0  0  0
 25 49  1  0  0  0  0
 25 50  1  0  0  0  0
M  END
>  <SKU>
A12929

>  <Product Name>
MI-2 (Menin-MLL inhibitor 2)

>  <CAS>
1271738-62-5

>  <M.Wt>
375.5546

>  <Formula>
C18H25N5S2

>  <Synonyms>
Menin-MLL inhibitor 2

>  <URL>
https://www.adooq.com/mi-2-menin-mll-inhibitor-2.html

$$$$
