KEGG   DRUG: D08935Help
Entry
D08935                      Drug                                   

Name
Ispronicline (INN/USAN)
Formula
C14H22N2O
Exact mass
234.1732
Mol weight
234.3373
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Treatment of cognitive and memory disorders [neuronal nicotinic receptor partial agonist]
Remark
Drug group: 
Target
selective nicotinic acetylcholine receptor alpha-4/beta-2 partial agonist [HSA:1137 1141] [KO:K04806 K04813]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04725  Cholinergic synapse  
 
Brite
Target-based classification of drugs [BR:br08310]
 Ion channels
  Cys-loop superfamily
   Acetylcholine (nicotinic)
    alpha4beta2 nicotinic receptor
     Ispronicline
      D08935  Ispronicline (INN/USAN)
BRITE hierarchy
Other DBs
CAS: 
252870-53-4
PubChem: 
LigandBox: 
LinkDB All DBs
KCF data Show

ATOM        17
            1   C8x C    21.4900  -15.2600
            2   N5x N    21.4900  -16.6600
            3   C8x C    22.7024  -17.3600
            4   C8y C    23.9149  -16.6600
            5   C8x C    23.9149  -15.2600
            6   C8y C    22.7024  -14.5600
            7   C2b C    25.1524  -17.3600
            8   C2b C    26.3649  -16.6600
            9   C1b C    27.5773  -17.3600
            10  C1c C    28.7897  -16.6600
            11  C1a C    30.0022  -17.3600
            12  N1b N    28.7897  -15.2601
            13  C1a C    27.5625  -14.5515
            14  O2a O    22.7024  -13.1602
            15  C1c C    21.4732  -12.4503
            16  C1a C    20.2692  -13.1454
            17  C1a C    21.4734  -11.0601
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     4   7 1
            8     7   8 2
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   10  12 1 #Up
            13   12  13 1
            14    6  14 1
            15   14  15 1
            16   15  16 1
            17   15  17 1

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