KEGG   DRUG: Amitifadine hydrochloride
Entry
D10089                      Drug                                   
Name
Amitifadine hydrochloride (USAN)
Formula
C11H11Cl2N. HCl
Exact mass
263.0035
Mol weight
264.5787
Structure
Simcomp
Remark
Chemical structure group: DG01386
Efficacy
Antidepressant
Comment
Treatment of depression
Target
SLC6A4 (HTT) [HSA:6532] [KO:K05037]
SLC6A2 (NAT1) [HSA:6530] [KO:K05035]
SLC6A3 (DAT1) [HSA:6531] [KO:K05036]
  Pathway
hsa04721  Synaptic vesicle cycle
hsa04726  Serotonergic synapse
hsa04728  Dopaminergic synapse
Brite
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC6
    SLC6A2 (NAT1)
     D10089  Amitifadine hydrochloride (USAN)
    SLC6A3 (DAT1)
     D10089  Amitifadine hydrochloride (USAN)
    SLC6A4 (HTT)
     D10089  Amitifadine hydrochloride (USAN)
Other DBs
CAS: 410074-74-7
PubChem: 135626808
LigandBox: D10089
KCF data

ATOM        15
            1   C8x C    27.0200  -20.8600
            2   C8y C    27.0200  -22.2600
            3   C8y C    25.8300  -22.9600
            4   C8x C    24.5700  -22.2600
            5   C8y C    24.5700  -20.8600
            6   C8x C    25.8300  -20.1600
            7   X   Cl   25.8300  -24.3600
            8   X   Cl   28.2100  -22.9600
            9   C1z C    23.3800  -20.1600
            10  C1y C    21.9800  -20.1600
            11  C1x C    22.6800  -21.3500
            12  C1x C    23.8000  -18.8300
            13  N1x N    22.6800  -17.9900
            14  C1x C    21.4900  -18.8300
            15  X   Cl   28.3500  -18.2700
BOND        16
            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     3   7 1
            8     2   8 1
            9     9   5 1 #Up
            10    9  10 1
            11   10  11 1
            12   11   9 1
            13    9  12 1
            14   12  13 1
            15   13  14 1
            16   10  14 1

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  All links  
Ontology (1)   
   KEGG BRITE (1)   
Drug (2)   
   KEGG DGROUP (1)   
   LigandBox (1)   
Chemical substance (1)   
   PubChem (1)   
Gene (6)   
   KEGG ORTHOLOGY (3)   
   KEGG GENES (3)   
All databases (10)   

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