KEGG   DRUG: Butaclamol hydrochlorideHelp
Entry
D02641                      Drug                                   

Name
Butaclamol hydrochloride (USAN)
Formula
C25H31NO. HCl
Exact mass
397.2172
Mol weight
397.9807
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Neuropsychiatric agent
 DG01478  Dopamine antagonist
  DG01473  Dopamine D1-receptor antagonist
  DG01474  Dopamine D2-receptor antagonist
Activity
Antipsychotic
Target
dopamine receptor D2 [HSA:1813] [KO:K04145];
dopamine receptor D1 [HSA:1812] [KO:K04144]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Gap junction
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    dopamine D1-receptor
     Butaclamol
      D02641  Butaclamol hydrochloride (USAN)
    dopamine D2-receptor
     Butaclamol
      D02641  Butaclamol hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
36504-94-6
PubChem: 
LigandBox: 
KCF data Show

ATOM        28
            1   C1x C    38.1323  -20.2909
            2   C8y C    37.2912  -19.1826
            3   C8y C    37.6260  -17.8274
            4   C1y C    38.8856  -17.2500
            5   C1x C    39.5365  -20.3161
            6   C8y C    40.1377  -17.8716
            7   C8y C    40.4239  -19.2387
            8   C8x C    36.6201  -16.8602
            9   C8x C    35.2797  -17.2478
            10  C8x C    34.9449  -18.6030
            11  C8x C    35.9508  -19.5700
            12  C8x C    41.7535  -19.6753
            13  C8x C    42.7965  -18.7420
            14  C8x C    42.5104  -17.3749
            15  C8y C    41.1806  -16.9383
            16  C1x C    38.9070  -15.8169
            17  N1y N    40.0665  -15.1313
            18  C1y C    41.1790  -15.8260
            19  C1x C    42.4149  -15.1683
            20  C1z C    42.3933  -13.7691
            21  C1x C    41.2108  -13.0745
            22  C1x C    40.0449  -13.7322
            23  C1d C    42.8433  -12.6379
            24  O1a O    43.6418  -14.4735
            25  C1a C    43.5433  -11.4255
            26  C1a C    41.5935  -12.0327
            27  C1a C    44.1130  -13.2527
            28  X   Cl   44.9400  -16.5900
BOND        31
            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  15 1
            22   18  19 1
            23   19  20 1
            24   20  21 1
            25   21  22 1
            26   17  22 1
            27   20  23 1 #Down
            28   20  24 1 #Up
            29   23  25 1
            30   23  26 1
            31   23  27 1

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