KEGG   DRUG: Exicorilant
Entry
D11665                      Drug                                   
Name
Exicorilant (USAN/INN)
Formula
C26H23F4N7O3S
Exact mass
589.1519
Mol weight
589.57
Structure
Efficacy
Antineoplastic, Glucocorticoid receptor antagonist
Comment
Treatment of prostate cancer and other solid tumors
Target
NR3C1 (GR) [HSA:2908] [KO:K05771]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Brite
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C1 (GR)
     D11665  Exicorilant (USAN/INN)
Other DBs
CAS: 1781244-77-6
PubChem: 405226532
LinkDB
KCF data

ATOM        41
            1   C8y C    14.9962  -16.1174
            2   C8y C    14.9962  -17.5189
            3   C1x C    16.1874  -18.2196
            4   C1y C    17.4488  -17.5189
            5   C1z C    17.4488  -16.1174
            6   C1x C    16.1874  -15.4166
            7   C1x C    18.6401  -18.2196
            8   C1x C    19.8313  -17.5189
            9   N1y N    19.8313  -16.1174
            10  C1x C    18.6401  -15.4166
            11  C5a C    17.4488  -14.7159
            12  O5a O    18.6401  -14.0151
            13  C8y C    16.2575  -14.0151
            14  C8x C    16.2575  -12.6136
            15  C8y C    14.9962  -11.9128
            16  C8x C    13.8049  -12.6136
            17  C8x C    13.8049  -14.0151
            18  N5x N    14.9962  -14.7159
            19  S4a S    21.0226  -15.4166
            20  C8y C    22.2138  -16.1174
            21  C8x C    22.2138  -17.5189
            22  N5x N    23.4752  -18.0094
            23  N4y N    24.3862  -16.8882
            24  N5x N    23.6154  -15.7670
            25  O3c O    22.0737  -14.4356
            26  O3c O    20.3218  -14.2253
            27  C1a C    25.8578  -16.8882
            28  C1d C    14.9962  -10.5113
            29  X   F    13.5947  -10.5113
            30  X   F    16.3977  -10.5113
            31  X   F    14.9962   -9.1098
            32  C8x C    13.6647  -15.6969
            33  N5x N    12.8238  -16.8181
            34  N4y N    13.6647  -18.0094
            35  C8y C    13.2443  -19.2708
            36  C8x C    11.9128  -19.6212
            37  C8x C    11.4223  -20.9525
            38  C8y C    12.4034  -22.0036
            39  C8x C    13.7348  -21.6532
            40  C8x C    14.1553  -20.3218
            41  X   F    11.9829  -23.2650
BOND        46
            1     1   2 2
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11    5  10 1
            12    5  11 1 #Up
            13   11  12 2
            14   11  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   16  17 1
            19   17  18 2
            20   13  18 1
            21    9  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 2
            25   22  23 1
            26   23  24 1
            27   20  24 2
            28   19  25 2
            29   19  26 2
            30   23  27 1
            31   15  28 1
            32   28  29 1
            33   28  30 1
            34   28  31 1
            35    1  32 1
            36   32  33 2
            37   33  34 1
            38    2  34 1
            39   34  35 1
            40   35  36 2
            41   36  37 1
            42   37  38 2
            43   38  39 1
            44   39  40 2
            45   35  40 1
            46   38  41 1

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