| Entry |
|
|---|
| Name |
Batanopride hydrochloride (USAN) |
|---|
| Formula |
C17H26ClN3O3. HCl
|
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| Exact mass |
391.1429
|
|---|
| Mol weight |
392.32
|
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| Structure |
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| Simcomp |
|
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| Class |
Gastrointestinal agent
DG01489 5-HT3-receptor antagonist
DG01762 Antiemetic
DG01783 Benzamide type antiemetic
|
|---|
| Efficacy |
Anti-emetic, Serotonin 5-HT3 receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Gastrointestinal agent
DG01489 5-HT3-receptor antagonist
D03060 Batanopride hydrochloride
DG01762 Antiemetic
DG01783 Benzamide type antiemetic
D03060 Batanopride hydrochloride
Target-based classification of drugs [BR:br08310]
Ion channels
Ligand-gated ion channels
Serotonin
HTR3
D03060 Batanopride hydrochloride (USAN)
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 25
1 C8y C 25.1625 -19.2382
2 C8y C 25.1625 -17.8342
3 C8x C 23.9624 -19.9314
4 C5a C 26.3801 -19.9314
5 C8x C 23.9624 -17.1294
6 O2a O 26.3801 -17.1294
7 C8y C 22.7449 -19.2382
8 N1b N 27.5917 -19.2323
9 O5a O 26.3801 -21.3352
10 C8y C 22.7449 -17.8342
11 X Cl 21.5333 -19.9314
12 C1b C 28.8092 -19.9314
13 N1a N 21.5333 -17.1294
14 C1b C 30.0208 -19.2323
15 N1c N 31.2383 -19.9256
16 C1b C 32.4501 -19.2323
17 C1b C 31.2383 -21.3295
18 C1a C 33.6560 -19.9256
19 C1a C 32.4501 -22.0343
20 C1c C 26.3817 -15.7500
21 C5a C 27.6012 -15.0478
22 C1a C 25.1763 -15.0522
23 C1a C 28.7978 -15.7407
24 O5a O 27.6029 -13.6502
25 X Cl 38.8500 -20.0900
BOND 24
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 4 8 1
8 4 9 2
9 5 10 1
10 7 11 1
11 8 12 1
12 10 13 1
13 12 14 1
14 14 15 1
15 15 16 1
16 15 17 1
17 16 18 1
18 17 19 1
19 7 10 2
20 6 20 1
21 20 21 1
22 20 22 1
23 21 23 1
24 21 24 2
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