| Entry |
|
|---|
| Name |
Azasetron hydrochloride (JAN);
Serotone (TN) |
|---|
| Formula |
C17H20ClN3O3. HCl
|
|---|
| Exact mass |
385.096
|
|---|
| Mol weight |
386.2729
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Gastrointestinal agent
DG01489 5-HT3-receptor antagonist
DG01762 Antiemetic
|
|---|
| Remark |
|
|---|
| Efficacy |
Anti-emetic, Serotonin 5-HT3 receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07211 | Serotonin receptor agonists/antagonists |
|
|---|
| Brite |
Drug groups [BR:br08330]
Gastrointestinal agent
DG01489 5-HT3-receptor antagonist
DG01521 Azasetron
D01613 Azasetron hydrochloride
DG01762 Antiemetic
DG01521 Azasetron
D01613 Azasetron hydrochloride
Target-based classification of drugs [BR:br08310]
Ion channels
Ligand-gated ion channels
Serotonin
HTR3
D01613 Azasetron hydrochloride (JAN)
Drug groups [BR:br08330]
Gastrointestinal agent
DG01489 5-HT3-receptor antagonist
DG01521 Azasetron
DG01762 Antiemetic
DG01521 Azasetron
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 25
1 X Cl 28.4703 -20.1965
2 C1y C 20.3053 -18.2374
3 N1b N 21.3698 -19.0891
4 C5a C 22.5763 -19.0891
5 C8y C 23.2151 -18.0245
6 O5a O 23.2151 -20.2956
7 C8y C 24.5635 -18.0245
8 O2x O 25.2732 -19.3020
9 C1x C 26.6926 -19.3020
10 C5x C 27.4023 -18.0245
11 N1y N 26.6926 -16.8180
12 C8y C 25.2732 -16.8180
13 C1x C 19.5956 -19.3020
14 N1y N 18.1052 -18.3794
15 C1x C 18.1052 -17.1729
16 C1x C 16.6148 -19.2310
17 C1y C 18.8859 -17.3858
18 C1x C 18.8859 -16.3922
19 C1x C 17.3245 -18.0955
20 C8x C 24.5635 -15.5406
21 C8y C 23.2151 -15.5406
22 C8x C 22.5054 -16.7471
23 X Cl 22.5054 -14.2631
24 O5x O 28.8217 -18.0245
25 C1a C 27.3898 -15.5992
BOND 27
1 2 3 1
2 3 4 1
3 4 5 1
4 4 6 2
5 5 7 1
6 7 8 1
7 8 9 1
8 9 10 1
9 10 11 1
10 11 12 1
11 7 12 2
12 13 14 1
13 13 2 1
14 14 15 1
15 14 16 1
16 2 17 1
17 15 18 1
18 16 19 1
19 17 18 1
20 17 19 1
21 12 20 1
22 20 21 2
23 21 22 1
24 5 22 2
25 21 23 1
26 10 24 2
27 11 25 1
|
|---|
