KEGG   DRUG: Deutenzalutamide
Entry
D12303                      Drug                                   
Name
Deutenzalutamide (USAN)
Formula
C21H16F4N4O2S
Exact mass
467.1118
Mol weight
464.44
Structure
Class
Antineoplastic
 DG01591  Androgen receptor antagonist
  DG01624  Flutamide-type antiandrogen
Efficacy
Antineoplastic, Androgen receptor antagonist
Comment
Treatment of prostate cancer
Target
NR3C4 (AR) [HSA:367] [KO:K08557]
  Pathway
hsa05200  Pathways in cancer
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG01591  Androgen receptor antagonist
   DG01624  Flutamide-type antiandrogen
    D12303  Deutenzalutamide
Target-based classification of drugs [BR:br08310]
 Nuclear receptors
  Estrogen like receptors
   3-Ketosteroid receptor
    NR3C4 (AR)
     D12303  Deutenzalutamide (USAN)
Other DBs
CAS: 1443331-82-5
PubChem: 497620716
LinkDB
KCF data

ATOM        32
            1   C8y C    19.3900  -28.9100
            2   C8y C    19.3900  -30.3100
            3   C8x C    18.2000  -31.0100
            4   C8x C    16.9400  -30.3100
            5   C8y C    16.9400  -28.9100
            6   C8x C    18.2000  -28.2100
            7   C1d C    20.5800  -28.2100
            8   C3b C    20.5800  -31.0100
            9   N3a N    21.7700  -31.7100
            10  X   F    21.7700  -27.5100
            11  X   F    21.2800  -29.4000
            12  X   F    19.8800  -27.0200
            13  N1y N    15.7500  -28.2100
            14  C5x C    14.5600  -28.9800
            15  C1z C    13.4400  -28.0700
            16  N1y N    13.9300  -26.8100
            17  C2y C    15.3300  -26.8100
            18  S0  S    16.2400  -25.7600
            19  O5x O    14.4200  -30.3100
            20  C1a C    12.1100  -28.4900
            21  C1a C    13.1600  -29.4700
            22  C8y C    13.1396  -25.6545
            23  C8x C    13.8948  -24.4283
            24  C8y C    13.2333  -23.1945
            25  C8y C    11.8340  -23.1504
            26  C8x C    11.0752  -24.3742
            27  C8x C    11.7367  -25.6080
            28  X   F    13.9813  -21.9887
            29  C5a C    11.1797  -21.9302
            30  N1b N     9.8002  -21.8866
            31  O5a O    11.9321  -20.7167
            32  C1a C     9.1485  -20.6708
BOND        34
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     2   8 1
            9     8   9 3
            10    7  10 1
            11    7  11 1
            12    7  12 1
            13    5  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   16  17 1
            18   13  17 1
            19   17  18 2
            20   14  19 2
            21   15  20 1
            22   15  21 1
            23   16  22 1
            24   22  23 2
            25   23  24 1
            26   24  25 2
            27   25  26 1
            28   26  27 2
            29   22  27 1
            30   24  28 1
            31   25  29 1
            32   29  30 1
            33   29  31 2
            34   30  32 1

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