KEGG   DRUG: Lofexidine
Entry
D08141                      Drug                                   
Name
Lofexidine (INN)
Formula
C11H12Cl2N2O
Exact mass
258.0327
Mol weight
259.1318
Structure
Simcomp
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01450  alpha-Adrenergic receptor agonist
   DG01449  alpha2-Adrenergic receptor agonist
Remark
ATC code: N07BC04
Chemical structure group: DG01001
Product (DG01001): D04765<US>
Efficacy
Antihypertensive, Vasodilator, alpha2-Adrenergic receptor agonist
Target
ADRA2 [HSA:150 151 152] [KO:K04138 K04139 K04140]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N07 OTHER NERVOUS SYSTEM DRUGS
   N07B DRUGS USED IN ADDICTIVE DISORDERS
    N07BC Drugs used in opioid dependence
     N07BC04 Lofexidine
      D08141  Lofexidine (INN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01456  Adrenergic receptor agonist
   DG01450  alpha-Adrenergic receptor agonist
    DG01449  alpha2-Adrenergic receptor agonist
     DG01001  Lofexidine
      D08141  Lofexidine
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRA2
     D08141  Lofexidine (INN)
Drug groups [BR:br08330]
 Cardiovascular agent
  DG01456  Adrenergic receptor agonist
   DG01450  alpha-Adrenergic receptor agonist
    DG01449  alpha2-Adrenergic receptor agonist
     DG01001  Lofexidine
Other DBs
CAS: 31036-80-3
PubChem: 96024831
LigandBox: D08141
NIKKAJI: J20.359I
LinkDB
KCF data

ATOM        16
            1   C8x C    20.0900  -18.1300
            2   C8x C    20.0900  -19.5300
            3   C8x C    21.3500  -20.2300
            4   C8y C    22.5400  -19.5300
            5   C8y C    22.5400  -18.1300
            6   C8y C    21.3500  -17.4300
            7   X   Cl   21.3500  -16.0300
            8   X   Cl   23.8000  -20.2300
            9   O2a O    23.8000  -17.4300
            10  C1c C    24.9900  -18.1300
            11  C2y C    26.1800  -17.4300
            12  C1a C    24.9900  -19.5300
            13  N1x N    27.5100  -17.8500
            14  C1x C    28.2800  -16.7300
            15  C1x C    27.5100  -15.6100
            16  N2x N    26.1800  -16.0300
BOND        17
            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     6   7 1
            8     4   8 1
            9     5   9 1
            10    9  10 1
            11   10  11 1
            12   10  12 1
            13   11  13 1
            14   13  14 1
            15   14  15 1
            16   15  16 1
            17   11  16 2

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