| Entry |
|
|---|
| Name |
Sunepitron hydrochloride (USAN)
|
|---|
| Formula |
C17H23N5O2. HCl
|
|---|
| Exact mass |
365.1619
|
|---|
| Mol weight |
365.8578
|
|---|
| Structure |
   |
|---|
| Class |
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01465 alpha-Adrenergic receptor antagonist
DG01460 alpha2-Adrenergic receptor antagonist
Neuropsychiatric agent
DG01483 5-HT1A-receptor agonist
|
|---|
| Efficacy |
Antianxiety, Antidepressant |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRA2
D02569 Sunepitron hydrochloride (USAN)
Serotonin
HTR1A
D02569 Sunepitron hydrochloride (USAN)
 |
|---|
| Other DBs |
|
|---|
| LinkDB |
 |
|---|
| KCF data |
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
|
|---|
