| Entry |
|
|---|
| Name |
Remoxipride hydrochloride (USAN)
|
|---|
| Formula |
C16H23BrN2O3. HCl. H2O
|
|---|
| Exact mass |
424.0764
|
|---|
| Mol weight |
425.7456
|
|---|
| Structure |
   |
|---|
| Simcomp |
 |
|---|
| Class |
Neuropsychiatric agent
DG01941 Benzamide antipsychotic
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
|
|---|
| Remark |
|
|---|
| Efficacy |
Antipsychotic, Dopamine D2 receptor antagonist |
|---|
| Comment |
Benzamide derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AL Benzamides
N05AL04 Remoxipride
D02683 Remoxipride hydrochloride (USAN)
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D02683 Remoxipride hydrochloride (USAN)
 |
|---|
| Other DBs |
|
|---|
| LinkDB |
 |
|---|
| KCF data |
ATOM 24
1 X Cl 24.9677 -15.8336
2 O0 O 25.3079 -17.8616
3 C8x C 12.5300 -17.1500
4 C8x C 12.5300 -15.7500
5 C8y C 13.7900 -15.0500
6 C8y C 13.7900 -17.8500
7 C8y C 14.9800 -17.1500
8 C8y C 14.9800 -15.7500
9 O2a O 16.1700 -15.0500
10 C5a C 16.1700 -17.8500
11 N1b N 17.4300 -17.1500
12 C1b C 18.6200 -17.8500
13 O5a O 16.1700 -19.2500
14 C1a C 16.1700 -13.6500
15 C1y C 19.8800 -17.2200
16 N1y N 21.0000 -17.9900
17 C1x C 22.1200 -17.1500
18 C1x C 21.6300 -15.8900
19 C1x C 20.3000 -15.8900
20 C1b C 21.0000 -19.3200
21 C1a C 22.3300 -20.0900
22 X Br 13.7900 -13.6500
23 O2a O 13.7900 -19.2500
24 C1a C 12.6000 -20.0200
BOND 23
1 11 10 1
2 10 7 1
3 3 4 2
4 4 5 1
5 12 11 1
6 5 8 2
7 7 6 2
8 6 3 1
9 10 13 2
10 7 8 1
11 8 9 1
12 9 14 1
13 15 12 1 #Down
14 15 16 1
15 16 17 1
16 17 18 1
17 18 19 1
18 15 19 1
19 16 20 1
20 20 21 1
21 5 22 1
22 6 23 1
23 23 24 1
|
|---|
