KEGG   DRUG: D01795Help
Entry
D01795                      Drug                                   

Name
Tilisolol hydrochloride (JAN);
Selecal (TN)
Formula
C17H24N2O3. HCl
Exact mass
340.1554
Mol weight
340.845
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
beta-Adrenergic blocking
Remark
Therapeutic category: 
Drug group: 
Target
beta1-adrenergic receptor antagonist [HSA:153] [KO:K04141];
beta2-adrenergic receptor antagonist [HSA:154] [KO:K04142];
beta3-adrenergic receptor antagonist [HSA:155] [KO:K04143]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04261  Adrenergic signaling in cardiomyocytes  
 
Interaction
Drug interaction
Brite
Therapeutic category of drugs in Japan [BR:br08301]
 2  Agents affecting individual organs
  21  Cardiovascular agents
   214  Antihypertensives
    2149  Others
     D01795  Tilisolol hydrochloride (JAN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    beta1-adrenergic receptor
     Tilisolol
      D01795  Tilisolol hydrochloride (JAN)
    beta2-adrenergic receptor
     Tilisolol
      D01795  Tilisolol hydrochloride (JAN)
    beta3-adrenergic receptor
     Tilisolol
      D01795  Tilisolol hydrochloride (JAN)
BRITE hierarchy
Other DBs
CAS: 
62774-96-3
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        23
            1   C8x C    26.1695  -19.1687
            2   C8x C    26.1695  -17.7696
            3   C8x C    27.3587  -17.0700
            4   C8x C    27.3587  -19.8682
            5   C8y C    28.5480  -19.1687
            6   C8y C    28.5480  -17.7696
            7   C8y C    29.8072  -17.0700
            8   C8x C    30.9964  -17.7696
            9   N4y N    30.9964  -19.1687
            10  C8y C    29.8072  -19.8682
            11  O5x O    29.8072  -21.2674
            12  O2a O    29.8072  -15.6709
            13  C1b C    30.9964  -14.9713
            14  C1c C    32.1857  -15.6709
            15  C1b C    33.4449  -14.9713
            16  N1b N    34.6341  -15.6709
            17  C1d C    35.8234  -15.0413
            18  O1a O    32.1857  -17.0700
            19  C1a C    35.8234  -13.6422
            20  C1a C    37.0826  -15.7408
            21  C1a C    37.0826  -14.3417
            22  C1a C    32.2556  -19.8682
            23  X   Cl   38.4843  -19.1696
BOND        23
            1     4   1 1
            2    10  11 2
            3     7  12 1
            4    12  13 1
            5     1   2 2
            6    13  14 1
            7     2   3 1
            8    14  15 1
            9     3   6 2
            10   15  16 1
            11    5   4 2
            12   16  17 1
            13    5   6 1
            14   14  18 1
            15    6   7 1
            16   17  19 1
            17    7   8 2
            18   17  20 1
            19    8   9 1
            20   17  21 1
            21    9  10 1
            22    9  22 1
            23   10   5 1

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