KEGG   DRUG: D08145Help
Entry
D08145                      Drug                                   

Name
Loprazolam mesilate;
Loprazolam mesylate;
Loprazolam methanesulfonate;
Havlane (TN)
Formula
C23H21ClN6O3. CH4SO3
Exact mass
560.1245
Mol weight
561.0099
Structure
Mol fileKCF fileDB searchJmolKegDraw
Activity
Hypnotic;
Tranquilizer
Remark
ATC code: 
Drug group: 
Target
GABAA-receptor (benzodiazepine binding site) agonist [HSA:2554 2555 2556 2557 2558 2559 2560 2561 2562 2563 2564 2565 2566 2567 2568 55879] [KO:K05175 K05181 K05184 K05185 K05186 K05189 K05192]
  Pathway
hsa04080  Neuroactive ligand-receptor interaction
hsa04727  GABAergic synapse  
 
Interaction
Drug interaction
Brite
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
 N NERVOUS SYSTEM
  N05 PSYCHOLEPTICS
   N05C HYPNOTICS AND SEDATIVES
    N05CD Benzodiazepine derivatives
     N05CD11 Loprazolam
      D08145  Loprazolam mesilate
Target-based classification of drugs [BR:br08310]
 Ion channels
  Cys-loop superfamily
   GABA-A
    GABAA-receptor (benzodiazepine binding site)
     Loprazolam
      D08145  Loprazolam mesilate
BRITE hierarchy
Other DBs
CAS: 
70111-54-5
PubChem: 
LigandBox: 
NIKKAJI: 
KCF data Show

ATOM        38
            1   C2y C    21.4200  -18.6900
            2   C8y C    21.9800  -17.4300
            3   C8y C    23.3800  -17.0100
            4   N1y N    24.5000  -17.8500
            5   N2x N    22.1200  -19.9500
            6   C2y C    24.5000  -19.2500
            7   C1x C    23.4500  -20.1600
            8   N2x N    25.9000  -19.6000
            9   C2y C    26.6700  -18.4800
            10  C5x C    25.7600  -17.3600
            11  C8y C    20.0200  -18.6900
            12  C8x C    19.2500  -17.5700
            13  C8x C    17.8500  -17.6400
            14  C8x C    17.2200  -18.8300
            15  C8x C    17.9200  -20.0200
            16  C8y C    19.3200  -19.9500
            17  C2b C    28.0700  -18.4100
            18  N1y N    28.7700  -19.6000
            19  C1x C    28.1400  -20.7900
            20  C1x C    28.9100  -21.9800
            21  N1y N    30.3100  -21.9100
            22  C1x C    30.9400  -20.7200
            23  C1x C    30.1700  -19.5300
            24  C8x C    23.7300  -15.6800
            25  C8x C    22.7500  -14.7000
            26  C8y C    21.3500  -15.0500
            27  C8x C    21.0000  -16.3800
            28  N2b N    20.3700  -14.0700 #+
            29  O3a O    18.9700  -14.4200
            30  O3a O    20.7200  -12.7400 #-
            31  X   Cl   20.0900  -21.1400
            32  O5x O    26.1800  -16.0300
            33  C1a C    31.0800  -23.1000
            34  S4a S    35.0000  -17.5700
            35  C1a C    36.4000  -17.5700
            36  O1d O    33.6000  -17.5700
            37  O1d O    35.0000  -16.1700
            38  O1d O    35.0000  -18.9700
BOND        41
            1     3   4 1
            2     1   5 2
            3     4   6 1
            4     2   3 2
            5     5   7 1
            6     1   2 1
            7     6   7 1
            8     6   8 2
            9     8   9 1
            10    9  10 1
            11    4  10 1
            12    1  11 1
            13   11  12 2
            14   12  13 1
            15   13  14 2
            16   14  15 1
            17   15  16 2
            18   11  16 1
            19    9  17 2
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   22  23 1
            26   18  23 1
            27    3  24 1
            28   24  25 2
            29   25  26 1
            30   26  27 2
            31    2  27 1
            32   26  28 1
            33   28  29 2
            34   28  30 1
            35   16  31 1
            36   10  32 2
            37   21  33 1
            38   34  35 1
            39   34  36 1
            40   34  37 2
            41   34  38 2

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