KEGG   DRUG: DapiprazoleHelp
Entry
D07775                      Drug                                   

Name
Dapiprazole (INN)
Formula
C19H27N5
Exact mass
325.2266
Mol weight
325.4512
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Cardiovascular agent
 DG01456  Adrenergic receptor agonist
  DG01450  alpha-Adrenergic receptor agonist
   DG01448  alpha1-Adrenergic receptor agonist
Remark
ATC code: S01EX02
Chemical structure group: DG01140
Efficacy
Antiglaucoma, Neuroleptic, alpha-Adrenergic receptor antagonist
Target
ADRA1 [HSA:148 147 146] [KO:K04135 K04136 K04137]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04270  Vascular smooth muscle contraction
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 S SENSORY ORGANS
  S01 OPHTHALMOLOGICALS
   S01E ANTIGLAUCOMA PREPARATIONS AND MIOTICS
    S01EX Other antiglaucoma preparations
     S01EX02 Dapiprazole
      D07775  Dapiprazole (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Adrenaline
    ADRA1
     D07775  Dapiprazole (INN)
BRITE hierarchy
Other DBs
CAS: 72822-12-9
PubChem: 96024473
ChEBI: 51066
ChEMBL: CHEMBL1201216
DrugBank: DB00298
LigandBox: D07775
NIKKAJI: J111.116G
LinkDB All DBs
KCF data Show

ATOM        24
            1   C1x C    13.7900  -24.4300
            2   C1x C    13.7900  -25.8300
            3   C1x C    15.0024  -26.5300
            4   C8y C    16.2149  -25.8300
            5   N4y N    16.2149  -24.4300
            6   C1x C    15.0024  -23.7300
            7   N5x N    17.5464  -26.2626
            8   N5x N    18.3693  -25.1300
            9   C8y C    17.5464  -23.9974
            10  C1b C    17.9775  -22.6706
            11  C1b C    19.3569  -22.3774
            12  N1y N    20.3195  -23.4469
            13  C1x C    19.8840  -24.7868
            14  C1x C    20.8207  -25.8273
            15  N1y N    22.1901  -25.5364
            16  C1x C    22.6256  -24.1965
            17  C1x C    21.6889  -23.1560
            18  C8y C    23.1335  -26.5843
            19  C8x C    22.4035  -27.8144
            20  C8x C    23.0834  -29.0382
            21  C8x C    24.4832  -29.0613
            22  C8x C    25.2159  -27.8391
            23  C8y C    24.5360  -26.6153
            24  C1a C    25.2746  -25.3902
BOND        27
            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 2
            8     7   8 1
            9     8   9 2
            10    5   9 1
            11    9  10 1
            12   10  11 1
            13   11  12 1
            14   12  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   16  17 1
            19   12  17 1
            20   15  18 1
            21   18  19 2
            22   19  20 1
            23   20  21 2
            24   21  22 1
            25   22  23 2
            26   18  23 1
            27   23  24 1

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