KEGG   DRUG: Quinpirole hydrochlorideHelp
Entry
D05682                      Drug                                   

Name
Quinpirole hydrochloride (USAN)
Formula
C13H21N3. HCl
Exact mass
255.1502
Mol weight
255.7869
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Neuropsychiatric agent
 DG01472  Dopamine agonist
  DG01468  Dopamine D2-receptor agonist
  DG01469  Dopamine D3-receptor agonist
Efficacy
Antihypertensive
Target
DRD2 [HSA:1813] [KO:K04145]
DRD3 [HSA:1814] [KO:K04146]
  Pathway
hsa04024  cAMP signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04728  Dopaminergic synapse
Interaction
Drug interaction
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Dopamine
    DRD2
     D05682  Quinpirole hydrochloride (USAN)
    DRD3
     D05682  Quinpirole hydrochloride (USAN)
BRITE hierarchy
Other DBs
CAS: 85798-08-9
PubChem: 47207343
ChEMBL: CHEMBL1256574
LigandBox: D05682
NIKKAJI: J276.268D
KCF data Show

ATOM        17
            1   C1x C    22.6772  -18.6148
            2   C1x C    22.6772  -20.0144
            3   N1y N    23.8892  -20.7141
            4   C1y C    25.1013  -20.0144
            5   C1y C    25.1013  -18.6148
            6   C1x C    23.8892  -17.9151
            7   C1x C    26.3133  -20.7141
            8   C8y C    27.5253  -20.0144
            9   C8y C    27.5253  -18.6148
            10  C1x C    26.3133  -17.9151
            11  C8x C    28.8564  -20.4468
            12  N5x N    29.6790  -19.3146
            13  N4x N    28.8564  -18.1824
            14  C1b C    23.8892  -22.1135
            15  C1b C    22.6604  -22.8231
            16  C1a C    22.6604  -24.2231
            17  X   Cl   28.8971  -22.6645
BOND        18
            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 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11    5  10 1
            12    8  11 1
            13   11  12 2
            14   12  13 1
            15    9  13 1
            16    3  14 1
            17   14  15 1
            18   15  16 1

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