| Entry |
|
|---|
| Name |
Clebopride (USAN);
Cleboril (TN) |
|---|
| Formula |
C20H24ClN3O2
|
|---|
| Exact mass |
373.1557
|
|---|
| Mol weight |
373.87
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
Gastrointestinal agent
DG01763 Propulsive
DG01762 Antiemetic
DG01783 Benzamide type antiemetic
|
|---|
| Remark |
|
|---|
| Efficacy |
Anti-emetic, Prokinetic, Dopamine receptor antagonist |
|---|
| Comment |
Benzamide derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07213 | Dopamine receptor agonists/antagonists |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A03 DRUGS FOR FUNCTIONAL GASTROINTESTINAL DISORDERS
A03F PROPULSIVES
A03FA Propulsives
A03FA06 Clebopride
D03534 Clebopride (USAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
DG00059 Clebopride
D03534 Clebopride
Gastrointestinal agent
DG01763 Propulsive
DG00059 Clebopride
D03534 Clebopride
DG01762 Antiemetic
DG01783 Benzamide type antiemetic
DG00059 Clebopride
D03534 Clebopride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D03534 Clebopride (USAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
DG00059 Clebopride
Gastrointestinal agent
DG01763 Propulsive
DG00059 Clebopride
DG01762 Antiemetic
DG01783 Benzamide type antiemetic
DG00059 Clebopride
|
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| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 26
1 C8x C 25.9000 -16.5200
2 C8x C 25.9000 -17.9200
3 C8x C 24.7100 -18.6200
4 C8y C 23.4500 -17.9200
5 C8x C 23.4500 -16.5200
6 C8x C 24.7100 -15.8200
7 C1b C 22.2600 -18.6200
8 N1y N 21.0000 -17.9200
9 C1x C 19.8100 -18.6200
10 C1x C 18.6200 -17.9200
11 C1y C 18.6200 -16.5200
12 C1x C 19.8100 -15.8200
13 C1x C 21.0000 -16.5200
14 N1b N 17.3600 -15.8200
15 C5a C 16.1700 -16.5200
16 C8y C 14.9800 -15.8200
17 O5a O 16.1700 -17.9200
18 C8x C 13.7900 -16.5200
19 C8y C 12.5300 -15.8200
20 C8y C 12.5300 -14.4200
21 C8x C 13.7900 -13.7200
22 C8y C 14.9800 -14.4200
23 O2a O 16.1700 -13.7200
24 N1a N 11.3400 -13.7200
25 X Cl 11.3400 -16.5200
26 C1a C 16.1700 -12.3200
BOND 28
1 15 17 2
2 7 8 1
3 1 2 2
4 2 3 1
5 3 4 2
6 4 5 1
7 16 18 2
8 18 19 1
9 19 20 2
10 20 21 1
11 21 22 2
12 22 16 1
13 5 6 2
14 22 23 1
15 8 9 1
16 9 10 1
17 20 24 1
18 10 11 1
19 19 25 1
20 11 12 1
21 12 13 1
22 13 8 1
23 6 1 1
24 11 14 1
25 14 15 1
26 4 7 1
27 15 16 1
28 23 26 1
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