KEGG   DRUG: AtomoxetineHelp
Entry
D07473                      Drug                                   

Name
Atomoxetine (USP/INN);
Tomoxetine
Formula
C17H21NO
Exact mass
255.1623
Mol weight
255.3547
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01970  Agents for ADHD
Enzyme substrate
 DG01644  CYP2D6 substrate
Remark
ATC code: N06BA09
Chemical structure group: DG00970
Product (DG00970): D02574<JP/US>
Efficacy
Stimulant (central), Selective noradrenaline reuptake inhibitor (NRI)
Comment
Fluoxetine derivative
Target
SLC6A2 (NAT1) [HSA:6530] [KO:K05035]
Metabolism
Enzyme: CYP2D6 [HSA:1565]
Interaction
Drug interaction
Structure map
map07234  Neurotransmitter transporter inhibitors
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N06 PSYCHOANALEPTICS
   N06B PSYCHOSTIMULANTS, AGENTS USED FOR ADHD AND NOOTROPICS
    N06BA Centrally acting sympathomimetics
     N06BA09 Atomoxetine
      D07473  Atomoxetine (USP/INN)
USP drug classification [BR:br08302]
 Central Nervous System Agents
  Attention Deficit Hyperactivity Disorder Agents, Non- amphetamines
   Atomoxetine
    D07473  Atomoxetine (USP/INN)
Target-based classification of drugs [BR:br08310]
 Transporters
  Solute carrier family
   SLC6
    SLC6A2 (NAT1)
     D07473  Atomoxetine (USP/INN)
BRITE hierarchy
Other DBs
CAS: 83015-26-3
PubChem: 51091800
ChEBI: 127342
ChEMBL: CHEMBL641
LigandBox: D07473
NIKKAJI: J525.770K
LinkDB All DBs
KCF data Show

ATOM        19
            1   C8x C    19.3200  -16.8700
            2   C8x C    19.3200  -18.2700
            3   C8x C    20.5100  -18.9700
            4   C8x C    21.7700  -18.2700
            5   C8y C    21.7700  -16.8700
            6   C8y C    20.5100  -16.1700
            7   C1a C    20.5100  -14.7700
            8   O2a O    22.9600  -16.1700
            9   C1c C    24.2200  -16.8700
            10  C1b C    25.4100  -16.1700
            11  C1b C    26.6000  -16.8700
            12  N1b N    27.8600  -16.1700
            13  C1a C    29.0500  -16.8700
            14  C8y C    24.2200  -18.2700
            15  C8x C    23.0300  -18.9700
            16  C8x C    23.0300  -20.3700
            17  C8x C    24.2200  -21.0700
            18  C8x C    25.4100  -20.3700
            19  C8x C    25.4100  -18.9700
BOND        20
            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     5   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14    9  14 1 #Down
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   17  18 1
            19   18  19 2
            20   14  19 1

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