KEGG   DRUG: Clocapramine hydrochloride hydrate
Entry
D02371                      Drug                                   

Name
Clocapramine hydrochloride hydrate (JP17);
Clofekton (TN)
Formula
C28H37ClN4O. 2HCl. H2O
Exact mass
570.2295
Mol weight
572.0097
Structure
Simcomp
Class
Neuropsychiatric agent
 DG01942  Iminobenzyl antipsychotic
 DG01478  Dopamine antagonist
  DG01474  Dopamine D2-receptor antagonist
Remark
Therapeutic category: 1179
Chemical structure group: DG01313
Product (DG01313): D02371<JP>
Efficacy
Antipsychotic, Neuroleptic, Dopamine D2 receptor antagonist
Comment
Iminodibenzyl derivative
Target
DRD2 [HSA:1813] [KO:K04145]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04540  Gap junction
Interaction
Structure map
map07213  Dopamine receptor agonists/antagonists
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 1  Agents affecting nervous system and sensory organs
  11  Agents affecting central nervous system
   117  Psychotropics
    1179  Others
     D02371  Clocapramine hydrochloride hydrate (JP17)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD2
     D02371  Clocapramine hydrochloride hydrate (JP17) <JP>
Drugs listed in the Japanese Pharmacopoeia [BR:br08311]
 Chemicals
  D02371  Clocapramine hydrochloride hydrate
Other DBs
PubChem: 7849430
LigandBox: D02371
LinkDB
KCF data

ATOM        37
            1   C1x C    15.4700  -20.7200
            2   C8y C    14.6300  -19.6000
            3   C8y C    14.9800  -18.2700
            4   N1y N    16.2400  -17.7100
            5   C1x C    16.8700  -20.7200
            6   C8y C    17.5000  -18.3400
            7   C8y C    17.7800  -19.6700
            8   C8x C    13.9300  -17.2900
            9   C8y C    12.6000  -17.7100
            10  C8x C    12.2500  -19.0400
            11  C8x C    13.3000  -20.0200
            12  C8x C    19.1100  -20.0900
            13  C8x C    20.1600  -19.1800
            14  C8x C    19.8800  -17.7800
            15  C8x C    18.5500  -17.3600
            16  C1b C    16.2718  -16.3104
            17  C1b C    17.4753  -15.6512
            18  C1b C    18.7026  -16.3967
            19  N1y N    19.9275  -15.7254
            20  C1x C    21.1515  -16.4686
            21  C1x C    22.3791  -15.7955
            22  C1z C    22.4100  -14.3959
            23  C1x C    21.1860  -13.6527
            24  C1x C    19.9584  -14.3257
            25  N1y N    23.6198  -13.7329
            26  C1x C    24.7888  -14.4431
            27  C1x C    26.0166  -13.7703
            28  C1x C    26.0478  -12.3707
            29  C1x C    24.8788  -11.6605
            30  C1x C    23.5810  -12.3332
            31  C5a C    23.7499  -15.7544
            32  N1a N    24.9621  -15.0852
            33  O5a O    23.7230  -17.1500
            34  X   Cl   11.5863  -16.7444
            35  X   Cl   24.9200  -18.7600
            36  O0  O    25.3400  -20.5100
            37  X   Cl   24.9200  -18.7600
BOND        38
            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 1
            8     3   8 2
            9     8   9 1
            10    9  10 2
            11   10  11 1
            12    2  11 2
            13    7  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17    6  15 2
            18    4  16 1
            19   16  17 1
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   19  24 1
            28   22  25 1
            29   25  26 1
            30   26  27 1
            31   27  28 1
            32   28  29 1
            33   29  30 1
            34   25  30 1
            35   22  31 1
            36   31  32 1
            37   31  33 2
            38    9  34 1
BRACKET     1    23.3100  -19.3900   23.3100  -17.9900
            1    25.6900  -17.9900   25.6900  -19.3900
            1  2
 ORIGINAL  1   35
 REPEAT    1   37

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