KEGG   DRUG: D09866Help
Entry
D09866                      Drug                                   

Name
Atopaxar (USAN)
Formula
C29H38FN3O5
Exact mass
527.2796
Mol weight
527.6275
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of cardiovascular disorders
Remark
Drug group: 
Target
coagulation factor II (thrombin) receptor (PAR1) antagonist [HSA:2149] [KO:K03914]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04610  Complement and coagulation cascades  
 
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Thrombin
    coagulation factor II (thrombin) receptor (PAR1)
     Atopaxar
      D09866  Atopaxar (USAN)
BRITE hierarchy
Other DBs
CAS: 
751475-53-3
PubChem: 
LigandBox: 
KCF data Show

ATOM        38
            1   C8y C    11.1300  -21.3500
            2   C8y C    11.1300  -22.7500
            3   C8x C    12.3424  -23.4500
            4   C8y C    13.5549  -22.7500
            5   C8y C    13.5549  -21.3500
            6   C8y C    12.3424  -20.6500
            7   C1x C    14.8864  -23.1826
            8   N1y N    15.7093  -22.0500
            9   C2y C    14.8864  -20.9174
            10  C1b C    17.0800  -22.0500
            11  X   F    12.3424  -19.2502
            12  O2a O     9.9176  -20.6500
            13  C1b C     8.7221  -21.3404
            14  C1a C     7.5347  -20.6549
            15  O2a O     9.9176  -23.4500
            16  C1b C     8.7221  -22.7596
            17  C1a C     7.5347  -23.4451
            18  N2a N    15.3175  -19.5906
            19  C5a C    17.7800  -23.2624
            20  C8y C    19.1800  -23.2624
            21  O5a O    17.0896  -24.4579
            22  C8x C    19.8704  -24.4579
            23  C8y C    21.2704  -24.4578
            24  C8y C    21.9703  -23.2453
            25  C8y C    21.2799  -22.0498
            26  C8x C    19.8799  -22.0499
            27  N1y N    21.9611  -25.6532
            28  C1x C    21.2806  -26.8328
            29  C1x C    21.9810  -28.0450
            30  O2x O    23.3810  -28.0445
            31  C1x C    24.0615  -26.8649
            32  C1x C    23.3611  -25.6527
            33  C1d C    21.9797  -20.8374
            34  O2a O    23.3800  -23.2451
            35  C1a C    24.0779  -24.4537
            36  C1a C    23.3798  -20.8372
            37  C1a C    21.2893  -19.6422
            38  C1a C    22.6797  -19.6249
BOND        41
            1     1   2 1
            2     2   3 2
            3     3   4 1
            4     4   5 2
            5     5   6 1
            6     1   6 2
            7     4   7 1
            8     7   8 1
            9     8   9 1
            10    5   9 1
            11    8  10 1
            12    6  11 1
            13    1  12 1
            14   12  13 1
            15   13  14 1
            16    2  15 1
            17   15  16 1
            18   16  17 1
            19    9  18 2
            20   10  19 1
            21   19  20 1
            22   19  21 2
            23   20  22 1
            24   22  23 2
            25   23  24 1
            26   24  25 2
            27   25  26 1
            28   20  26 2
            29   23  27 1
            30   27  28 1
            31   28  29 1
            32   29  30 1
            33   30  31 1
            34   31  32 1
            35   27  32 1
            36   25  33 1
            37   24  34 1
            38   34  35 1
            39   33  36 1
            40   33  37 1
            41   33  38 1

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