KEGG   DRUG: Verdinexor
Entry
D11223                      Drug                                   

Name
Verdinexor (USAN/INN)
Formula
C18H12F6N6O
Exact mass
442.0977
Mol weight
442.3179
Structure
Simcomp
Efficacy
Antineoplastic, Nuclear export inhibitor
Comment
Treatment of canine lymphorma
Target
XPO1 [HSA:7514] [KO:K14290]
  Pathway
hsa03013  RNA transport
Brite
Target-based classification of drugs [BR:br08310]
 Transporters
  Other transporters
   Channels and pores (TC:1)
    XPO1
     D11223  Verdinexor (USAN/INN)
Other DBs
CAS: 1392136-43-4
PubChem: 384585201
ChEMBL: CHEMBL3545187
LinkDB
KCF data

ATOM        31
            1   C8x C    12.9501  -15.3301
            2   C8y C    12.9501  -16.7301
            3   C8x C    14.1401  -17.4301
            4   C8y C    15.4001  -16.7301
            5   C8x C    15.4001  -15.3301
            6   C8y C    14.1401  -14.6301
            7   C1d C    14.1401  -13.2301
            8   X   F    12.7401  -13.2301
            9   X   F    15.5401  -13.2301
            10  X   F    14.1401  -11.8301
            11  C1d C    11.7601  -17.4301
            12  X   F    11.0601  -16.2401
            13  X   F    12.4601  -18.6902
            14  X   F    10.5001  -18.1302
            15  C8y C    16.5901  -17.4301
            16  N5x N    16.6601  -18.8302
            17  N4y N    17.9902  -19.2502
            18  C8x C    18.7602  -18.1302
            19  N5x N    17.9202  -17.0101
            20  C2b C    18.4102  -20.5802
            21  C2b C    19.8102  -20.5802
            22  C5a C    20.5102  -19.3902
            23  N1b N    21.9102  -19.3902
            24  O5a O    19.8102  -18.2002
            25  N1b N    22.6102  -18.2002
            26  C8y C    24.0102  -18.2002
            27  N5x N    24.7102  -19.3902
            28  C8x C    26.1102  -19.3902
            29  C8x C    26.8102  -18.2002
            30  C8x C    26.1102  -16.9401
            31  C8x C    24.7102  -16.9401
BOND        33
            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     6   7 1
            8     7   8 1
            9     7   9 1
            10    7  10 1
            11    2  11 1
            12   11  12 1
            13   11  13 1
            14   11  14 1
            15    4  15 1
            16   15  16 2
            17   16  17 1
            18   17  18 1
            19   18  19 2
            20   15  19 1
            21   17  20 1
            22   20  21 2
            23   21  22 1
            24   22  23 1
            25   22  24 2
            26   23  25 1
            27   25  26 1
            28   26  27 2
            29   27  28 1
            30   28  29 2
            31   29  30 1
            32   30  31 2
            33   26  31 1

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