KEGG   DRUG: D10194Help
Entry
D10194                      Drug                                   

Name
Remimazolam besilate (JAN)
Formula
C21H19BrN4O2. C6H6O3S
Exact mass
596.0729
Mol weight
597.4802
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
Drug group: 
Target
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04727  GABAergic synapse  
 
Brite
Target-based classification of drugs [BR:br08310]
 Ion channels
  Cys-loop superfamily
   GABA-A
    GABAA-receptor
     Remimazolam
      D10194  Remimazolam besilate (JAN)
BRITE hierarchy
Other DBs
PubChem: 
LigandBox: 
KCF data Show

ATOM        38
            1   C8y C    17.2900  -15.1200
            2   N4y N    18.5500  -14.5600
            3   C8y C    19.8100  -15.1900
            4   C1y C    20.0900  -16.5200
            5   C8y C    16.9400  -16.5200
            6   N2x N    19.2500  -17.6400
            7   C2y C    17.8500  -17.6400
            8   N5x N    20.7900  -14.1400
            9   C8x C    20.0900  -12.9500
            10  C8y C    18.6900  -13.1600
            11  C1a C    17.7100  -12.1800
            12  C8x C    16.2400  -14.2100
            13  C8x C    14.9100  -14.6300
            14  C8y C    14.6300  -15.9600
            15  C8x C    15.6100  -16.9400
            16  X   Br   13.3000  -16.3800
            17  C8y C    17.2200  -18.9000
            18  C8x C    15.8200  -18.9000
            19  C8x C    15.1200  -20.1600
            20  C8x C    15.8200  -21.3500
            21  C8x C    17.2200  -21.3500
            22  N5x N    17.9200  -20.0900
            23  C1b C    21.2800  -17.2200
            24  C1b C    22.4700  -16.5200
            25  C7a C    23.6600  -17.2200
            26  O7a O    24.8500  -16.5200
            27  O6a O    23.6600  -18.6200
            28  C1a C    26.0400  -17.2200
            29  C8x C    28.6300  -18.1300
            30  C8x C    28.6300  -19.5300
            31  C8x C    29.8424  -20.2300
            32  C8x C    31.0549  -19.5300
            33  C8x C    31.0549  -18.1300
            34  C8y C    29.8424  -17.4300
            35  S4a S    29.8424  -16.0302
            36  O1d O    31.2424  -16.0302
            37  O1d O    28.4424  -16.0302
            38  O1d O    29.8424  -14.6302
BOND        41
            1     3   4 1
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 2
            8     3   8 2
            9     8   9 1
            10    9  10 2
            11    2  10 1
            12   10  11 1
            13    1  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    5  15 2
            18   14  16 1
            19    7  17 1
            20   17  18 1
            21   18  19 2
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   17  22 2
            26    4  23 1 #Down
            27   23  24 1
            28   24  25 1
            29   25  26 1
            30   25  27 2
            31   26  28 1
            32   29  30 2
            33   30  31 1
            34   31  32 2
            35   32  33 1
            36   33  34 2
            37   29  34 1
            38   34  35 1
            39   35  36 2
            40   35  37 2
            41   35  38 1

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