KEGG   COMPOUND: C06952
Entry
C06952                      Compound                               
Name
Cimetidine
Formula
C10H16N6S
Exact mass
252.1157
Mol weight
252.34
Structure
Remark
Same as: D00295
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 A ALIMENTARY TRACT AND METABOLISM
  A02 DRUGS FOR ACID RELATED DISORDERS
   A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
    A02BA H2-receptor antagonists
     A02BA01 Cimetidine
      D00295  Cimetidine (JP18/USP/INN) <JP/US>
USP drug classification [BR:br08302]
 Gastrointestinal Agents
  Histamine2 (H2) Receptor Antagonists
   Cimetidine
    D00295  Cimetidine (JP18/USP/INN)
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  23  Digestive organ agents
   232  Peptic ulcer agents
    2325  H2 blockers
     D00295  Cimetidine (JP18/USP/INN)
Classification of Japanese OTC drugs [BR:br08313]
 Agents for digestive organs
  09 Histamine H2 receptor blocker containing drugs
   D00295  Cimetidine (JP18/USP/INN)
Risk category of Japanese OTC drugs [BR:br08312]
 First-class OTC drugs
  Inorganic and organic chemicals
   Cimetidine
    D00295  Cimetidine (JP18/USP/INN)
Drug groups [BR:br08330]
 Gastrointestinal agent
  DG01975  Agents for peptic ulcer
   DG01481  Histamine receptor H2 antagonist
    DG00017  Cimetidine
     D00295  Cimetidine
 Metabolizing enzyme inhibitor
  DG01645  CYP2D6 inhibitor
   DG00017  Cimetidine
    D00295  Cimetidine
  DG02852  CYP3A/CYP3A4 inhibitor
   DG01522  CYP3A4 inhibitor
    DG00017  Cimetidine
     D00295  Cimetidine
Drug classes [BR:br08332]
 Gastrointestinal agent
  DG01481  Histamine receptor H2 antagonist
   D00295  Cimetidine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    HRH2
     D00295  Cimetidine (JP18/USP/INN) <JP/US>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D00295  Cimetidine
Drug metabolizing enzymes and transporters [br08309.html]
 Drug metabolizing enzymes
  D00295
Rx-to-OTC switch list in the USA [br08315.html]
 D00295
Rx-to-OTC switch list in Japan [br08314.html]
 D00295
Other DBs
CAS: 51481-61-9
PubChem: 9167
KCF data

ATOM        17
            1   C1b C    24.5161  -17.2081
            2   S2a S    25.7286  -16.5110
            3   C1b C    26.9410  -17.2081
            4   C1b C    28.1533  -16.5110
            5   N1b N    29.3656  -17.2081
            6   C2c C    30.5840  -16.5110
            7   N2b N    30.5840  -15.1055
            8   N1b N    31.7963  -17.2081
            9   C3b C    31.7963  -14.4084
            10  C1a C    33.0088  -16.5110
            11  N3a N    33.0237  -13.7126
            12  C8y C    23.3233  -16.5169
            13  N5x N    23.3233  -15.1155
            14  C8x C    21.9904  -14.6825
            15  N4x N    21.1666  -15.8162
            16  C8y C    21.9904  -16.9500
            17  C1a C    21.5563  -18.2858
BOND        17
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 2
            7     6   8 1
            8     7   9 1
            9     8  10 1
            10    9  11 3
            11    1  12 1
            12   12  13 1
            13   13  14 2
            14   14  15 1
            15   15  16 1
            16   12  16 2
            17   16  17 1

» Japanese version

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Drug (1)   
   KEGG DRUG (1)   
Chemical substance (20)   
   PubChem (1)   
   HMDB (1)   
   HSDB (1)   
   MASSBANK (17)   
All databases (21)   

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