KEGG   DRUG: Pebezertinib
Entry
D12859                      Drug                                   
Name
Pebezertinib (USAN)
Formula
C24H19F4N7O
Exact mass
497.1587
Mol weight
497.45
Structure
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
   DG03162  EGFR inhibitor
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
EGFR* [HSA_VAR:1956v2] [HSA:1956] [KO:K04361]
  Pathway
hsa04010  MAPK signaling pathway
hsa04012  ErbB signaling pathway
hsa05200  Pathways in cancer
Interaction
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    DG03162  EGFR inhibitor
     D12859  Pebezertinib
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   EGFR family
    EGFR* [HSA_VAR:1956v2]
     D12859  Pebezertinib (USAN)
Other DBs
CAS: 2769954-39-2
PubChem: 497621272
LinkDB
KCF data

ATOM        36
            1   C2b C    19.9798  -23.7467
            2   C5a C    21.1726  -24.4483
            3   N1b N    22.3655  -23.7467
            4   O5a O    21.1726  -25.8517
            5   C2a C    18.7869  -24.4483
            6   C8y C    22.3655  -22.3433
            7   C8x C    23.5583  -21.6417
            8   C8x C    23.5583  -20.2383
            9   C8y C    22.3655  -19.5366
            10  C8y C    21.1726  -20.2383
            11  C8x C    21.1726  -21.6417
            12  X   F    22.3655  -18.1333
            13  N1b N    19.9798  -19.5366
            14  C8y C    19.9798  -18.1333
            15  N5x N    21.1726  -17.4316
            16  C8y C    21.1726  -16.0283
            17  N5x N    19.9798  -15.3266
            18  C8x C    18.7168  -16.0283
            19  C8y C    18.7168  -17.4316
            20  N1b N    22.3908  -15.3315
            21  C8y C    23.5821  -16.0260
            22  C8y C    17.5073  -18.1433
            23  C8x C    16.2947  -17.4564
            24  C8x C    15.0851  -18.1679
            25  C8y C    15.0965  -19.5712
            26  C8x C    16.3091  -20.2582
            27  C8x C    17.5187  -19.5466
            28  C1d C    13.8816  -20.2861
            29  X   F    12.6663  -20.9878
            30  X   F    13.1800  -19.0708
            31  X   F    14.5833  -21.5015
            32  C8x C    23.5327  -17.4314
            33  N5x N    24.8509  -17.9118
            34  N4y N    25.7152  -16.8065
            35  C8x C    24.9311  -15.6431
            36  C1a C    27.1357  -16.7866
BOND        39
            1     1   2 1
            2     2   3 1
            3     2   4 2
            4     1   5 2
            5     3   6 1
            6     6   7 2
            7     7   8 1
            8     8   9 2
            9     9  10 1
            10   10  11 2
            11    6  11 1
            12    9  12 1
            13   10  13 1
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   14  19 1
            21   16  20 1
            22   20  21 1
            23   19  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   25  28 1
            31   28  29 1
            32   28  30 1
            33   28  31 1
            34   21  32 1
            35   32  33 2
            36   33  34 1
            37   34  35 1
            38   21  35 2
            39   34  36 1

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