KEGG   DRUG: Tavapadon
Entry
D11431                      Drug                                   
Name
Tavapadon (USAN/INN)
Formula
C19H16F3N3O3
Exact mass
391.1144
Mol weight
391.34
Structure
Efficacy
Antiparkinsonian, Dementia therapeutic agent, Dopamine receptor agonist
Comment
Treatment of Parkinson's disease, cognitive impairment, apathy in Alzheimer's disease
Target
DRD1 [HSA:1812] [KO:K04144]
DRD5 [HSA:1816] [KO:K05840]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD1
     D11431  Tavapadon (USAN/INN)
    DRD5
     D11431  Tavapadon (USAN/INN)
Other DBs
CAS: 1643489-24-0
PubChem: 384585408
PDB-CCD: 86W[PDBj]
LinkDB
KCF data

ATOM        28
            1   C8x C     7.9100  -13.5800
            2   C8x C     7.9100  -14.9800
            3   C8y C     9.1224  -15.6800
            4   C8y C    10.3349  -14.9800
            5   N5x N    10.3349  -13.5800
            6   C8x C     9.1224  -12.8800
            7   C1d C     9.1224  -17.0798
            8   O2a O    11.5660  -15.6910
            9   X   F     7.7224  -17.0798
            10  X   F    10.5224  -17.0798
            11  X   F     9.1224  -18.4798
            12  C8y C    12.7712  -14.9953
            13  C8x C    13.9535  -15.6781
            14  C8y C    15.1660  -14.9783
            15  C8y C    15.1662  -13.5783
            16  C8x C    13.9838  -12.8955
            17  C8x C    12.7713  -13.5953
            18  C8y C    16.3956  -12.8684
            19  C8y C    17.6013  -13.5645
            20  C8y C    18.8137  -12.8645
            21  N4x N    18.8138  -11.4645
            22  C8y C    17.6082  -10.7684
            23  N4y N    16.3957  -11.4684
            24  C1a C    17.6015  -14.9796
            25  O5x O    20.0451  -13.5754
            26  O5x O    17.6085   -9.3804
            27  C1a C    15.1767  -10.7644
            28  C1a C    16.3970  -15.6893
BOND        30
            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     4   8 1
            9     7   9 1
            10    7  10 1
            11    7  11 1
            12    8  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1
            19   15  18 1
            20   18  19 2
            21   19  20 1
            22   20  21 1
            23   21  22 1
            24   22  23 1
            25   18  23 1
            26   19  24 1
            27   20  25 2
            28   22  26 2
            29   23  27 1
            30   14  28 1

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