KEGG   DRUG: HydroxyzineHelp
Entry
D08054                      Drug                                   

Name
Hydroxyzine (INN);
Marex (TN)
Formula
C21H27ClN2O2
Exact mass
374.1761
Mol weight
374.9043
Structure
Mol fileKCF fileDB search
Simcomp SIMCOMP
Class
Anti-allergic agent
 DG01557  Histamine receptor antagonist
  DG01482  Histamine receptor H1 antagonist
Enzyme substrate
 DG01633  CYP3A substrate
Remark
Same as: C07045
ATC code: N05BB01
Chemical structure group: DG00912
Product (DG00912): D00672<JP/US> D01096<JP/US>
Efficacy
Tranquilizer, H1 receptor antagonist
Target
HRH1 [HSA:3269] [KO:K04149]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction
Interaction
Drug interaction
Structure map
map07030  Anxiolytics
map07032  Hypnotics
map07212  Histamine H1 receptor antagonists
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05B ANXIOLYTICS
    N05BB Diphenylmethane derivatives
     N05BB01 Hydroxyzine
      D08054  Hydroxyzine (INN)
USP drug classification [BR:br08302]
 Antiemetics
  Antiemetics, Other
   Hydroxyzine
    D08054  Hydroxyzine (INN)
 Anxiolytics
  Anxiolytics, Other
   Hydroxyzine
    D08054  Hydroxyzine (INN)
 Respiratory Tract/Pulmonary Agents
  Antihistamines
   Hydroxyzine
    D08054  Hydroxyzine (INN)
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    HRH1
     D08054  Hydroxyzine (INN)
BRITE hierarchy
Other DBs
CAS: 68-88-2
PubChem: 96024747
ChEBI: 5818
ChEMBL: CHEMBL896
DrugBank: DB00557
LigandBox: D08054
NIKKAJI: J4.860G
LinkDB All DBs
KCF data Show

ATOM        26
            1   C8x C    21.0700  -18.2700
            2   C8y C    21.0700  -19.6700
            3   C8x C    22.2600  -20.3700
            4   C8x C    23.5200  -19.6700
            5   C8y C    23.5200  -18.2700
            6   C8x C    22.2600  -17.5700
            7   C8x C    25.9000  -19.6700
            8   C8y C    25.9000  -18.2700
            9   C1c C    24.7100  -17.5700
            10  N1y N    24.7100  -16.1700
            11  C1x C    25.9000  -15.4700
            12  C1x C    25.9000  -14.0700
            13  N1y N    24.7100  -13.3700
            14  C1x C    23.5200  -14.0700
            15  C1x C    23.5200  -15.4700
            16  C8x C    27.1600  -20.3700
            17  C8x C    28.3500  -19.6700
            18  C8x C    28.3500  -18.2700
            19  C8x C    27.1600  -17.5700
            20  X   Cl   19.8800  -20.3700
            21  C1b C    24.7100  -11.9700
            22  C1b C    25.9000  -11.2700
            23  O2a O    27.0900  -11.9700
            24  C1b C    28.2800  -11.2700
            25  C1b C    29.4700  -11.9700
            26  O1a O    30.6600  -11.2700
BOND        28
            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     7   8 1
            8     8   9 1
            9     5   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13   12  13 1
            14   13  14 1
            15   14  15 1
            16   10  15 1
            17    7  16 2
            18   16  17 1
            19   17  18 2
            20   18  19 1
            21    8  19 2
            22    2  20 1
            23   13  21 1
            24   21  22 1
            25   22  23 1
            26   23  24 1
            27   24  25 1
            28   25  26 1

» Japanese version   » Back

DBGET integrated database retrieval system