KEGG   DRUG: Vebreltinib
Entry
D12053                      Drug                                   
Name
Vebreltinib (USAN)
Formula
C20H15F3N8
Exact mass
424.1372
Mol weight
424.38
Structure
Class
Antineoplastic
 DG01918  Tyrosine kinase inhibitor
  DG01917  Receptor tyrosine kinase inhibitor
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
MET* [HSA_VAR:4233v4] [HSA:4233] [KO:K05099]
Interaction
Brite
Drug groups [BR:br08330]
 Antineoplastic
  DG01918  Tyrosine kinase inhibitor
   DG01917  Receptor tyrosine kinase inhibitor
    D12053  Vebreltinib
Target-based classification of drugs [BR:br08310]
 Protein kinases
  Receptor tyrosine kinases (RTK)
   MET family
    MET* [HSA_VAR:4233v4]
     D12053  Vebreltinib (USAN)
Other DBs
CAS: 1440964-89-5
PubChem: 497620466
LinkDB
KCF data

ATOM        31
            1   C8x C    13.3700  -14.0000
            2   C8y C    13.3700  -15.4000
            3   N5x N    14.5600  -16.1000
            4   N4y N    15.8200  -15.4000
            5   C8y C    15.8200  -14.0000
            6   C8x C    14.5600  -13.3000
            7   C8y C    17.1500  -15.8200
            8   N5x N    17.9200  -14.7000
            9   N5x N    17.1500  -13.5800
            10  C8y C    12.1800  -16.1000
            11  C8x C    11.0600  -15.3300
            12  N4y N     9.8700  -16.2400
            13  N5x N    10.3600  -17.5000
            14  C8x C    11.8300  -17.4300
            15  C1y C     8.5400  -15.7500
            16  C1d C    17.6400  -17.1500
            17  C8y C    19.0400  -17.4300
            18  X   F    16.7300  -18.2000
            19  X   F    16.2400  -16.8700
            20  C8y C    19.4600  -18.7600
            21  C8x C    20.8600  -19.0400
            22  C8y C    21.7700  -17.9900
            23  C8y C    21.2800  -16.6600
            24  C8x C    19.9500  -16.3800
            25  N5x N    23.1700  -17.9200
            26  N4y N    23.5900  -16.5900
            27  C8x C    22.4700  -15.7500
            28  X   F    18.5500  -19.8100
            29  C1a C    24.9200  -16.1700
            30  C1x C     7.1400  -15.7500
            31  C1x C     7.8400  -14.5600
BOND        36
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 2
            9     8   9 1
            10    5   9 2
            11    2  10 1
            12   10  11 2
            13   11  12 1
            14   12  13 1
            15   13  14 2
            16   10  14 1
            17   12  15 1
            18    7  16 1
            19   16  17 1
            20   16  18 1
            21   16  19 1
            22   17  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   17  24 2
            28   22  25 2
            29   25  26 1
            30   26  27 1
            31   23  27 2
            32   20  28 1
            33   26  29 1
            34   30  15 1
            35   15  31 1
            36   31  30 1

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