KEGG   DRUG: Acepromazine maleateHelp
Entry
D02604                      Drug                                   

Name
Acepromazine maleate (USP)
Formula
C19H22N2OS. C4H4O4
Exact mass
442.1562
Mol weight
442.5279
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01905  Phenothiazine antipsychotics
Remark
ATC code: N05AA04
Chemical structure group: DG00870
Efficacy
Sedative (veterinary)
Comment
Phenothiazine derivative
Target
DRD2 [HSA:1813] [KO:K04145]
DRD1 [HSA:1812] [KO:K04144]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
Interaction
Drug interaction
Structure map
map07029  Antipsychotics - phenothiazines
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05A ANTIPSYCHOTICS
    N05AA Phenothiazines with aliphatic side-chain
     N05AA04 Acepromazine
      D02604  Acepromazine maleate (USP)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD1
     D02604  Acepromazine maleate (USP)
    DRD2
     D02604  Acepromazine maleate (USP)
BRITE hierarchy
Other DBs
CAS: 3598-37-6
PubChem: 17396774
ChEMBL: CHEMBL1883146
LigandBox: D02604
NIKKAJI: J220.170D
KCF data Show

ATOM        31
            1   C8y C    14.0700  -17.6400
            2   C8y C    14.0700  -19.0400
            3   C8x C    15.2824  -19.7400
            4   C8x C    16.4949  -19.0400
            5   C8y C    16.4949  -17.6400
            6   C8x C    15.2824  -16.9400
            7   N1y N    12.8576  -16.9400
            8   C8y C    11.6451  -17.6400
            9   C8y C    11.6451  -19.0400
            10  S2x S    12.8576  -19.7400
            11  C8x C    10.4327  -16.9400
            12  C8x C     9.2203  -17.6400
            13  C8x C     9.2203  -19.0400
            14  C8x C    10.4327  -19.7400
            15  C1b C    12.8576  -15.5402
            16  C1b C    14.0868  -14.8303
            17  C1b C    14.0868  -13.4303
            18  N1c N    15.2824  -12.7400
            19  C1a C    16.4779  -13.4304
            20  C1a C    15.2825  -11.3402
            21  C5a C    17.7260  -16.9290
            22  C1a C    18.9312  -17.6247
            23  O5a O    17.7257  -15.5401
            24  C2b C    25.4100  -16.5200
            25  C2b C    27.2300  -16.5200
            26  C6a C    24.7100  -17.7324
            27  C6a C    27.9300  -17.7324
            28  O6a O    23.3102  -17.7324
            29  O6a O    25.4004  -18.9279
            30  O6a O    29.3298  -17.7324
            31  O6a O    27.2396  -18.9279
BOND        32
            1     1   2 2
            2     2   3 1
            3     3   4 2
            4     4   5 1
            5     5   6 2
            6     1   6 1
            7     1   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    2  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16    9  14 1
            17    7  15 1
            18   15  16 1
            19   16  17 1
            20   17  18 1
            21   18  19 1
            22   18  20 1
            23    5  21 1
            24   21  22 1
            25   21  23 2
            26   24  25 2
            27   24  26 1
            28   25  27 1
            29   26  28 1
            30   26  29 2
            31   27  30 2
            32   27  31 1

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