KEGG   DRUG: Fuzapladib sodium hydrate
Entry
D11919                      Drug                                   
Name
Fuzapladib sodium hydrate (JAN)
Formula
C15H19F3N3O3S. Na. H2O
Exact mass
419.1103
Mol weight
419.3949
Structure
Efficacy
Anti-inflammatory
Target
ITGB2 (CD18) [HSA:3689] [KO:K06464]
ITGAM (CD11B) [HSA:3684] [KO:K06461]
  Pathway
hsa04514  Cell adhesion molecules
Brite
Target-based classification of drugs [BR:br08310]
 Cell surface molecules and ligands
  Cell adhesion molecules: other families
   Integrins
    ITGAM (CD11B)
     D11919  Fuzapladib sodium hydrate (JAN)
    ITGB2 (CD18)
     D11919  Fuzapladib sodium hydrate (JAN)
LinkDB
KCF data

ATOM        27
            1   C8y C    20.2300  -13.7200
            2   N5x N    20.2300  -12.3200
            3   C8x C    19.0400  -11.6200
            4   C8y C    17.7800  -12.3200
            5   C8x C    17.7800  -13.7200
            6   C8y C    19.0400  -14.4200
            7   N1b N    19.0400  -15.8200
            8   N1b N    21.4200  -14.4200 #-
            9   S4a S    22.6100  -13.7200
            10  C1b C    23.8700  -13.0200
            11  O3c O    23.3100  -14.9100
            12  O3c O    21.9100  -12.5300
            13  C1a C    25.0600  -13.7200
            14  C1d C    16.5900  -11.6200
            15  X   F    15.3300  -10.9200
            16  X   F    15.8900  -12.8100
            17  X   F    17.2900  -10.4300
            18  C5a C    17.8247  -16.5151
            19  C1y C    16.6363  -15.8223
            20  O5a O    17.8189  -17.9197
            21  C1x C    16.6421  -14.4201
            22  C1x C    15.4325  -13.7151
            23  C1x C    14.2172  -14.4101
            24  C1x C    14.2114  -15.8122
            25  C1x C    15.4209  -16.5173
            26  Z   Na   21.0000  -16.2400 #+
            27  O0  O    25.6200  -17.9900
BOND        26
            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     1   8 1
            9     8   9 1
            10    9  10 1
            11    9  11 2
            12    9  12 2
            13   10  13 1
            14    4  14 1
            15   14  15 1
            16   14  16 1
            17   14  17 1
            18    7  18 1
            19   18  19 1
            20   18  20 2
            21   19  21 1
            22   21  22 1
            23   22  23 1
            24   23  24 1
            25   24  25 1
            26   19  25 1

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