KEGG   DRUG: D09750Help
Entry
D09750                      Drug                                   

Name
Ipidacrine hydrochloride hydrate (JAN)
Formula
C12H16N2. HCl. H2O
Exact mass
242.1186
Mol weight
242.7451
Structure
Mol fileKCF fileDB searchJmolKegDraw
Remark
ATC code: 
Target
acetylcholinesterase (AChE) inhibitor [HSA:43] [KO:K01049]
  Pathway
hsa00564  Glycerophospholipid metabolism
hsa04725  Cholinergic synapse  
 
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06D ANTI-DEMENTIA DRUGS
    N06DA Anticholinesterases
     N06DA05 Ipidacrine
      D09750  Ipidacrine hydrochloride hydrate (JAN)
Target-based classification of drugs [BR:br08310]
 Enzymes
  Hydrolases
   acetylcholinesterase (AChE)
    Ipidacrine
     D09750  Ipidacrine hydrochloride hydrate (JAN)
BRITE hierarchy
Other DBs
PubChem: 
LigandBox: 
KCF data Show

ATOM        16
            1   C1x C    19.1100  -20.1600
            2   C1x C    19.1100  -21.5600
            3   C1x C    20.3224  -22.2600
            4   C8y C    21.5349  -21.5600
            5   C8y C    21.5349  -20.1600
            6   C1x C    20.3224  -19.4600
            7   N5x N    22.7473  -22.2600
            8   C8y C    23.9597  -21.5600
            9   C8y C    23.9597  -20.1600
            10  C8y C    22.7473  -19.4600
            11  C1x C    25.2912  -21.9926
            12  C1x C    26.1141  -20.8600
            13  C1x C    25.2912  -19.7274
            14  N1a N    22.7473  -18.0600
            15  X   Cl   28.2800  -19.6000
            16  O0  O    28.7000  -21.0700
BOND        16
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     5   6 1
            6     1   6 1
            7     4   7 2
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  10 2
            12    8  11 1
            13   11  12 1
            14   12  13 1
            15    9  13 1
            16   10  14 1

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