KEGG   DRUG: Ipidacrine hydrochloride hydrateHelp
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
Class
Neuropsychiatric agent
 DG01595  Cholinesterase inhibitor
  DG01593  Acetylcholinesterase inhibitor
Remark
ATC code: 
Activity
Nootropic, Acetylcholinesterase inhibitor
Target
acetylcholinesterase (AChE) [HSA:43] [KO:K01049]
  Pathway
Glycerophospholipid metabolism
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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