KEGG   DRUG: Gisadenafil besylate
Entry
D09622                      Drug                                   
Name
Gisadenafil besylate (USAN)
Formula
C23H33N7O5S. C6H6O3S
Exact mass
677.2302
Mol weight
677.7921
Structure
Class
Cardiovascular agent
 DG01509  Phosphodiesterase V inhibitor
Remark
Chemical structure group: DG01258
Efficacy
Antidysuria, Phosphodiesterase V inhibitor
Comment
Treatment of lower urinary tract symptoms associated with BPH
Target
PDE5 [HSA:8654] [KO:K13762]
  Pathway
hsa00230  Purine metabolism
Interaction
Brite
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01509  Phosphodiesterase V inhibitor
   DG01258  Gisadenafil
    D09622  Gisadenafil besylate
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases (EC3)
   Phosphodiesterases
    PDE5
     D09622  Gisadenafil besylate (USAN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01509  Phosphodiesterase V inhibitor
   DG01258  Gisadenafil
Other DBs
CAS: 334827-98-4
PubChem: 124490362
LigandBox: D09622
LinkDB
KCF data

ATOM        46
            1   C1x C    16.1700  -26.9500
            2   N1y N    16.1700  -28.3500
            3   C1x C    17.3600  -29.0500
            4   C1x C    18.6200  -28.3500
            5   N1y N    18.6200  -26.9500
            6   C1x C    17.3600  -26.2500
            7   S4a S    19.8100  -26.2500
            8   C1b C    14.9800  -29.0500
            9   C1a C    13.7900  -28.3500
            10  C8y C    21.0000  -26.9500
            11  C8x C    21.0000  -28.3500
            12  N5x N    22.2600  -29.0500
            13  C8y C    23.5200  -28.3500
            14  C8y C    23.5200  -26.9500
            15  C8x C    22.2600  -26.2500
            16  C8y C    24.7100  -26.2500
            17  O2a O    24.7100  -29.0500
            18  C1b C    25.9000  -28.3500
            19  C1a C    27.0900  -29.0500
            20  N5x N    25.9000  -26.9500
            21  C8y C    27.1600  -26.2500
            22  C8y C    27.1600  -24.8500
            23  C8y C    25.9700  -24.1500
            24  N4x N    24.7100  -24.8500
            25  O5x O    25.9700  -22.7500
            26  C8y C    28.4900  -26.6700
            27  N4y N    29.3300  -25.5500
            28  N5x N    28.4900  -24.4300
            29  C1b C    30.7300  -25.5500
            30  C1b C    31.4300  -26.7400
            31  O2a O    32.8300  -26.7400
            32  C1a C    33.5300  -27.9300
            33  C1b C    29.1900  -27.8600
            34  C1a C    30.5900  -27.8600
            35  O1d O    20.5100  -24.9900
            36  O1d O    19.1100  -24.9900
            37  C8x C    30.0300  -33.1100
            38  C8x C    30.0300  -34.5100
            39  C8x C    31.2424  -35.2100
            40  C8x C    32.4549  -34.5100
            41  C8x C    32.4549  -33.1100
            42  C8y C    31.2424  -32.4100
            43  S4a S    31.2424  -31.0100
            44  O1d O    31.2424  -29.6100
            45  O1d O    29.8424  -31.0100
            46  O1d O    32.6424  -31.0100
BOND        49
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     5   7 1
            8     2   8 1
            9     8   9 1
            10    7  10 1
            11   10  11 2
            12   11  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   10  15 1
            17   14  16 1
            18   13  17 1
            19   17  18 1
            20   18  19 1
            21   16  20 2
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   23  24 1
            26   16  24 1
            27   23  25 2
            28   21  26 2
            29   26  27 1
            30   27  28 1
            31   22  28 2
            32   27  29 1
            33   29  30 1
            34   30  31 1
            35   31  32 1
            36   33  34 1
            37   33  26 1
            38    7  35 2
            39    7  36 2
            40   37  38 2
            41   38  39 1
            42   39  40 2
            43   40  41 1
            44   41  42 2
            45   37  42 1
            46   42  43 1
            47   43  44 1
            48   43  45 2
            49   43  46 2

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