KEGG   DRUG: Bucindolol hydrochlorideHelp
Entry
D03170                      Drug                                   

Name
Bucindolol hydrochloride (USAN)
Formula
C22H25N3O2. HCl
Exact mass
399.1714
Mol weight
399.9137
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Cardiovascular agent
 DG01466  Adrenergic receptor antagonist
  DG01464  beta-Adrenergic receptor antagonist
   DG01461  beta1-Adrenergic receptor antagonist
   DG01462  beta2-Adrenergic receptor antagonist
   DG01463  beta3-Adrenergic receptor antagonist
Activity
Antihypertensive
Target
beta1-adrenergic receptor [HSA:153] [KO:K04141];
beta2-adrenergic receptor [HSA:154] [KO:K04142];
beta3-adrenergic receptor [HSA:155] [KO:K04143]
  Pathway
Calcium signaling pathway
Neuroactive ligand-receptor interaction
Adrenergic signaling in cardiomyocytes
Salivary secretion
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Bucindolol
      D03170  Bucindolol hydrochloride (USAN)
    beta2-adrenergic receptor
     Bucindolol
      D03170  Bucindolol hydrochloride (USAN)
    beta3-adrenergic receptor
     Bucindolol
      D03170  Bucindolol hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 
70369-47-0
PubChem: 
LigandBox: 
KCF data Show

ATOM        28
            1   C8x C    19.5952  -17.7197
            2   C8x C    19.5892  -16.3101
            3   C8x C    18.3086  -18.4215
            4   C8y C    18.3086  -15.6082
            5   C8x C    17.0920  -17.7137
            6   C8y C    17.0920  -16.3101
            7   C3b C    15.8756  -15.6082
            8   N3a N    14.6602  -14.9179
            9   O2a O    18.3099  -14.2089
            10  C1b C    19.5225  -13.5107
            11  C1c C    20.7337  -14.2114
            12  C1b C    21.9463  -13.5130
            13  N1b N    23.1573  -14.2140
            14  C1d C    24.3697  -13.5156
            15  O1a O    20.7322  -15.6108
            16  C1b C    25.5597  -14.2044
            17  C8y C    26.7476  -13.5204
            18  C1a C    25.5836  -12.8148
            19  C1a C    23.1560  -12.8148
            20  C8x C    26.7476  -12.1204
            21  C8y C    28.0791  -13.9530
            22  C8y C    28.9020  -12.8204
            23  N4x N    28.0791  -11.6877
            24  C8x C    28.6485  -15.2320
            25  C8x C    30.0408  -15.3783
            26  C8x C    30.8637  -14.2457
            27  C8x C    30.2943  -12.9667
            28  X   Cl   28.0605  -17.5766
BOND        29
            1    13  14 1
            2     6   7 1
            3     7   8 3
            4     5   6 2
            5     4   9 1
            6     1   2 1
            7     9  10 1
            8     1   3 2
            9    10  11 1
            10    2   4 2
            11   11  12 1
            12    3   5 1
            13   12  13 1
            14   15  11 1
            15    4   6 1
            16   14  16 1
            17   16  17 1
            18   14  18 1
            19   14  19 1
            20   17  20 2
            21   17  21 1
            22   21  22 1
            23   22  23 1
            24   20  23 1
            25   21  24 2
            26   24  25 1
            27   25  26 2
            28   26  27 1
            29   22  27 2

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