KEGG   DRUG: Sunepitron hydrochlorideHelp
Entry
D02569                      Drug                                   

Name
Sunepitron hydrochloride (USAN)
Formula
C17H23N5O2. HCl
Exact mass
365.1619
Mol weight
365.8578
Structure
Mol fileKCF fileDB searchJmolKegDraw
Class
Cardiovascular agent
 DG01466  Adrenergic receptor antagonist
  DG01465  alpha-Adrenergic receptor antagonist
   DG01460  alpha2-Adrenergic receptor antagonist
Neuropsychiatric agent
 DG01483  5-HT1A-receptor agonist
Activity
Anti-anxiety agent, Antidepressant
Target
5-HT1A-receptor agonist [HSA:3350] [KO:K04153];
alpha2-adrenergic receptor antagonist [HSA:150 151 152] [KO:K04138 K04139 K04140]
Other DBs
CAS: 
148408-65-5
PubChem: 
LigandBox: 
LinkDB All DBs
KCF data Show

ATOM        25
            1   C8x C    25.5140  -20.0147
            2   C8x C    25.5140  -18.6096
            3   N5x N    26.7082  -17.9071
            4   C8y C    27.9728  -18.6096
            5   N5x N    27.9728  -20.0147
            6   C8x C    26.7082  -20.7172
            7   N1y N    29.1670  -17.9071
            8   C1x C    29.1670  -16.5022
            9   C1x C    30.4316  -15.7997
            10  N1y N    31.6259  -16.5022
            11  C1y C    31.6259  -17.9071
            12  C1x C    30.4316  -18.6096
            13  C1x C    32.8201  -15.7997
            14  C1y C    34.0847  -16.5022
            15  C1x C    34.0847  -17.9071
            16  C1x C    32.8201  -18.6096
            17  C1b C    35.2790  -15.7997
            18  N1y N    36.4732  -16.5022
            19  C5x C    37.6048  -15.7102
            20  C1x C    38.6881  -16.5027
            21  C1x C    38.2938  -17.7952
            22  C5x C    36.9299  -17.7725
            23  O5x O    36.0684  -18.8689
            24  O5x O    37.6143  -14.2774
            25  X   Cl   27.0199  -13.5800
BOND        27
            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     4   7 1
            8     7   8 1
            9     8   9 1
            10    9  10 1
            11   10  11 1
            12   11  12 1
            13    7  12 1
            14   10  13 1
            15   13  14 1
            16   14  15 1
            17   15  16 1
            18   11  16 1
            19   14  17 1 #Up
            20   17  18 1
            21   18  19 1
            22   19  20 1
            23   20  21 1
            24   21  22 1
            25   18  22 1
            26   22  23 2
            27   19  24 2

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