KEGG   DRUG: D05196Help
Entry
D05196                      Drug                                   

Name
Noberastine (USAN/INN)
Formula
C17H21N5O
Exact mass
311.1746
Mol weight
311.3815
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Antihistaminic
Remark
Drug group: 
Target
H1-receptor antagonist [HSA:3269] [KO:K04149]
  Pathway
hsa04020  Calcium signaling pathway
hsa04080  Neuroactive ligand-receptor interaction  
 
Brite
Target-based classification of drugs [BR:br08310]
 G Protein-coupled receptors
  Rhodopsin family
   Histamine
    H1-receptor
     Noberastine
      D05196  Noberastine (USAN/INN)
BRITE hierarchy
Other DBs
CAS: 
110588-56-2
PubChem: 
LigandBox: 
KCF data Show

ATOM        23
            1   N1x N    26.7030  -19.6775
            2   C1x C    27.8981  -20.3805
            3   C1x C    29.1635  -19.6775
            4   C1y C    29.1635  -18.2715
            5   C1x C    27.8981  -17.5686
            6   C1x C    26.7030  -18.2715
            7   N1b N    30.3586  -17.5686
            8   C8y C    31.5536  -18.2715
            9   N5x N    31.5544  -19.6672
            10  C8y C    32.8952  -20.0901
            11  C8y C    33.6992  -18.9432
            12  N4y N    32.8803  -17.8004
            13  C8x C    33.5166  -21.3917
            14  C8x C    34.8961  -21.3884
            15  C8x C    35.7001  -20.3115
            16  N5x N    35.1246  -18.9580
            17  C1b C    32.8803  -16.4004
            18  C8y C    34.1164  -15.6869
            19  C8x C    34.1164  -14.2869
            20  O2x O    35.4479  -16.1195
            21  C8y C    36.2708  -14.9869
            22  C8x C    35.4479  -13.8543
            23  C1a C    37.6600  -14.9869
BOND        26
            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     9  10 1
            10   10  11 2
            11   11  12 1
            12   12   8 1
            13    9   8 2
            14   10  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19   12  17 1
            20   17  18 1
            21   18  19 2
            22   18  20 1
            23   20  21 1
            24   21  22 2
            25   19  22 1
            26   21  23 1

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