KEGG   DRUG: MoperoneHelp
Entry
D02623                      Drug                                   

Name
Moperone (INN)
Formula
C22H26FNO2
Exact mass
355.1948
Mol weight
355.4457
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Neuropsychiatric agent
 DG01940  Butyrophenone derivative
 DG01478  Dopamine antagonist
  DG01474  Dopamine D2-receptor antagonist
Remark
ATC code: 
Chemical group: 
Activity
Antipsychotic, Dopamine D2 receptor antagonist
Comment
Butyrophenone derivative
Target
DRD2 [HSA:1813] [KO:K04145]
  Pathway
Neuroactive ligand-receptor interaction
Gap junction
Interaction
Drug interaction
Structure map
Butyrophenones
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AD Butyrophenone derivatives
     N05AD04 Moperone
      D02623  Moperone (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D2-receptor
     Moperone
      D02623  Moperone (INN)
BRITE hierarchy
Other DBs
CAS: 
1050-79-9
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        26
            1   C1b C    19.8100  -17.5700
            2   C1b C    21.0700  -16.8700
            3   C1b C    22.2600  -17.5700
            4   N1y N    23.4500  -16.8700
            5   C1x C    23.4500  -15.4700
            6   C1x C    24.6400  -17.5700
            7   C1x C    24.6400  -14.7700
            8   C1x C    25.8300  -16.8700
            9   C1z C    25.8300  -15.4700
            10  C8y C    27.0200  -14.7700
            11  C8x C    27.0200  -13.3700
            12  C8x C    28.2100  -15.4700
            13  C8x C    28.2100  -12.6700
            14  C8x C    29.4000  -14.7700
            15  C8y C    29.4000  -13.4400
            16  C1a C    30.5900  -12.6700
            17  C5a C    18.6200  -16.8000
            18  C8y C    17.3600  -17.5700
            19  O5a O    18.6200  -15.4000
            20  C8x C    17.3600  -18.9700
            21  C8x C    16.1700  -19.6700
            22  C8y C    14.9100  -18.9700
            23  C8x C    14.9100  -17.5700
            24  C8x C    16.1700  -16.8000
            25  X   F    13.6500  -19.6700
            26  O1a O    27.0200  -16.1700
BOND        28
            1     9  10 1
            2    10  11 1
            3    10  12 2
            4    11  13 2
            5    12  14 1
            6    13  15 1
            7    15  16 1
            8     8   9 1
            9    14  15 2
            10    1  17 1
            11    1   2 1
            12   17  18 1
            13    2   3 1
            14   17  19 2
            15    3   4 1
            16    4   5 1
            17    4   6 1
            18    5   7 1
            19    6   8 1
            20   18  20 1
            21   20  21 2
            22   21  22 1
            23   22  23 2
            24   23  24 1
            25   24  18 2
            26    7   9 1
            27   22  25 1
            28    9  26 1

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