KEGG   DRUG: Befunolol
Entry
D07496                      Drug                                   
Name
Befunolol (INN)
Formula
C16H21NO4
Exact mass
291.1471
Mol weight
291.34
Structure
Simcomp
Class
Cardiovascular agent
 DG01466  Adrenergic receptor antagonist
  DG01464  beta-Adrenergic receptor antagonist (Beta blocker)
Ophthalmic agent
 DG03201  Intraocular pressure lowering agent
Remark
ATC code: S01ED06
Chemical structure group: DG01138
Efficacy
Antiglaucoma, beta-Adrenergic receptor antagonist
Comment
Propranolol derivative
Target
ADRB [HSA:153 154 155] [KO:K04141 K04142 K04143]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01ED Beta blocking agents
     S01ED06 Befunolol
      D07496  Befunolol (INN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01466  Adrenergic receptor antagonist
   DG01464  beta-Adrenergic receptor antagonist (Beta blocker)
    DG01138  Befunolol
     D07496  Befunolol
 Ophthalmic agent
  DG03201  Intraocular pressure lowering agent
   DG01138  Befunolol
    D07496  Befunolol
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRB
     D07496  Befunolol (INN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01466  Adrenergic receptor antagonist
   DG01464  beta-Adrenergic receptor antagonist (Beta blocker)
    DG01138  Befunolol
 Ophthalmic agent
  DG03201  Intraocular pressure lowering agent
   DG01138  Befunolol
Other DBs
CAS: 39552-01-7
PubChem: 51091821
LigandBox: D07496
NIKKAJI: J16.631F
LinkDB
KCF data

ATOM        21
            1   O2a O    20.0200  -19.4600
            2   C1b C    21.2800  -18.7600
            3   C1c C    22.4700  -19.4600
            4   C1b C    23.6600  -18.7600
            5   N1b N    24.9200  -19.4600
            6   C1c C    26.1100  -18.7600
            7   C1a C    27.3000  -19.4600
            8   C1a C    26.1100  -17.3600
            9   O1a O    22.4700  -20.8600
            10  C8y C    20.0200  -20.8600
            11  C8y C    18.8300  -21.5600
            12  C8y C    18.8300  -22.9600
            13  C8x C    20.0200  -23.6600
            14  C8x C    21.2100  -22.9600
            15  C8x C    21.2100  -21.5600
            16  O2x O    17.5000  -21.1400
            17  C8y C    16.6600  -22.2600
            18  C8x C    17.5000  -23.3800
            19  C5a C    15.2600  -22.2600
            20  C1a C    14.5600  -21.0700
            21  O5a O    14.5600  -23.4500
BOND        22
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     6   7 1
            7     6   8 1
            8     3   9 1
            9     1  10 1
            10   10  11 2
            11   11  12 1
            12   12  13 2
            13   13  14 1
            14   14  15 2
            15   10  15 1
            16   11  16 1
            17   16  17 1
            18   17  18 2
            19   12  18 1
            20   17  19 1
            21   19  20 1
            22   19  21 2

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