KEGG   DRUG: Bisulepin
Entry
D07532                      Drug                                   
Name
Bisulepin
Formula
C17H21NS2
Exact mass
303.1115
Mol weight
303.4853
Structure
Simcomp
Efficacy
Antiallergic, H1 receptor antagonist
Target
HRH1 [HSA:3269] [KO:K04149]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04750  Inflammatory mediator regulation of TRP channels
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    HRH1
     D07532  Bisulepin
Other DBs
CAS: 5802-61-9
PubChem: 51091855
ChEBI: 135277
LigandBox: D07532
NIKKAJI: J21.372A
LinkDB
KCF data

ATOM        20
            1   C8y C    29.2546  -17.3124
            2   C1y C    30.5203  -16.7236
            3   C8y C    31.7778  -17.3402
            4   C8y C    32.0759  -18.6981
            5   C8y C    28.9312  -18.6838
            6   S2x S    31.2000  -19.7935
            7   C1x C    29.7986  -19.7831
            8   S2x S    33.4594  -18.8342
            9   C8x C    34.0164  -17.5605
            10  C8x C    32.9771  -16.6372
            11  C8x C    28.2353  -16.3528
            12  C8x C    26.8946  -16.7557
            13  C8x C    26.5711  -18.1270
            14  C8x C    27.5904  -19.0867
            15  C1b C    30.5346  -15.3301
            16  C1b C    31.7430  -14.6487
            17  C1b C    32.9156  -15.3417
            18  N1c N    34.1281  -14.6579
            19  C1a C    35.3441  -15.3769
            20  C1a C    34.1421  -13.2301
BOND        22
            1     3   4 2
            2     1   5 1
            3     4   6 1
            4     2   3 1
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     4   8 1
            9     8   9 1
            10    9  10 2
            11    3  10 1
            12    1  11 2
            13   11  12 1
            14   12  13 2
            15   13  14 1
            16    5  14 2
            17    2  15 1
            18   15  16 1
            19   16  17 1
            20   17  18 1
            21   18  19 1
            22   18  20 1

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