KEGG   DRUG: Avutometinib potassium
Entry
D12534                      Drug                                   
Name
Avutometinib potassium (USAN)
Formula
C21H17FN5O5S. K
Exact mass
509.0571
Mol weight
509.55
Structure
Class
Antineoplastic
 DG03137  MEK inhibitor
Remark
Chemical structure group: DG03255
Product (mixture): D13120<US>
Efficacy
Antineoplastic, Tyrosine kinase inhibitor
Target
MAP2K (MEK) [HSA:5604 5605] [KO:K04368 K04369]
RAF1 [HSA:5894] [KO:K04366]
  Pathway
hsa04010  MAPK signaling pathway
hsa04012  ErbB signaling pathway
hsa04014  Ras signaling pathway
hsa05200  Pathways in cancer
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG03137  MEK inhibitor
   DG03255  Avutometinib
    D12534  Avutometinib potassium
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Serine/threonine kinases
   STE group
    MAP2K (MEK)
     D12534  Avutometinib potassium (USAN)
   TKL group
    RAF1
     D12534  Avutometinib potassium (USAN)
Drug groups [BR:br08330]
 Antineoplastic
  DG03137  MEK inhibitor
   DG03255  Avutometinib
Other DBs
CAS: 946128-90-1
PubChem: 497620947
LinkDB
KCF data

ATOM        34
            1   C8x C     8.9075  -14.5884
            2   C8x C     8.9075  -15.9911
            3   C8x C    10.0998  -16.6924
            4   N5x N    11.3622  -15.9911
            5   C8y C    11.3622  -14.5884
            6   N5x N    10.0998  -13.8870
            7   O2a O    12.5545  -13.8870
            8   C8y C    13.8170  -14.5884
            9   C8x C    13.8170  -15.9911
            10  C8x C    15.0093  -16.6924
            11  C8y C    16.2016  -15.9911
            12  C8y C    16.2016  -14.5884
            13  C8x C    15.0093  -13.8870
            14  C8y C    17.4641  -16.6924
            15  C8y C    18.6564  -15.9911
            16  C8y C    18.6564  -14.5884
            17  O7x O    17.4641  -13.8870
            18  C1b C    19.8487  -16.6924
            19  C8y C    21.1112  -15.9911
            20  O6a O    19.8487  -13.8870
            21  C1a C    17.4641  -18.0952
            22  C8y C    22.3035  -16.6924
            23  C8y C    23.4958  -15.9911
            24  N5x N    23.4958  -14.5884
            25  C8x C    22.3035  -13.8870
            26  C8x C    21.1112  -14.5884
            27  N1b N    24.6881  -16.6924 #-
            28  S4a S    25.9506  -15.9911
            29  N1b N    27.1429  -16.6924
            30  C1a C    28.3352  -15.9911
            31  X   F    22.3035  -18.0952
            32  O3c O    25.2492  -14.7988
            33  O3c O    26.6519  -14.7988
            34  Z   K    24.7800  -18.6200 #+
BOND        36
            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     5   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14    8  13 1
            15   11  14 1
            16   14  15 2
            17   15  16 1
            18   16  17 1
            19   12  17 1
            20   15  18 1
            21   18  19 1
            22   16  20 2
            23   14  21 1
            24   19  22 2
            25   22  23 1
            26   23  24 2
            27   24  25 1
            28   25  26 2
            29   19  26 1
            30   23  27 1
            31   27  28 1
            32   28  29 1
            33   29  30 1
            34   22  31 1
            35   28  32 2
            36   28  33 2

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