KEGG   DRUG: Vebreltinib
Entry
D12053                      Drug                                   

Name
Vebreltinib (USAN)
Formula
C20H15F3N8
Exact mass
424.1372
Mol weight
424.3819
Structure
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
MET* [HSA_VAR:4233v4] [HSA:4233] [KO:K05099]
Brite
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
ChEMBL: CHEMBL4650443
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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