| Entry |
|
|---|
| Name |
Thioproperazine (INN) |
|---|
| Formula |
C22H30N4O2S2
|
|---|
| Exact mass |
446.181
|
|---|
| Mol weight |
446.6292
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
DG03200 Antipsychotic agent
DG01905 Phenothiazine antipsychotics
|
|---|
| Remark |
|
|---|
| Efficacy |
Antipsychotic, Neuroleptic, Dopamine D2 receptor antagonist |
|---|
| Comment |
Phenothiazine derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Structure map |
| map07029 | Antipsychotics - phenothiazines |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AB Phenothiazines with piperazine structure
N05AB08 Thioproperazine
D08585 Thioproperazine (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
DG00879 Thioproperazine
D08585 Thioproperazine
DG03200 Antipsychotic agent
DG01905 Phenothiazine antipsychotics
DG00879 Thioproperazine
D08585 Thioproperazine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD2
D08585 Thioproperazine (INN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG01474 Dopamine D2-receptor antagonist
DG00879 Thioproperazine
DG03200 Antipsychotic agent
DG01905 Phenothiazine antipsychotics
DG00879 Thioproperazine
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 30
1 S2x S 22.3300 -22.5400
2 N1y N 22.3300 -19.7400
3 C8y C 23.5900 -20.4400
4 C8y C 23.5900 -21.8400
5 C8x C 24.7800 -22.5400
6 C8x C 25.9700 -21.8400
7 C8y C 25.9700 -20.4400
8 C8x C 24.7800 -19.7400
9 C8y C 21.1400 -21.8400
10 C8y C 21.1400 -20.4400
11 C8x C 19.9500 -19.7400
12 C8x C 18.6900 -20.4400
13 C8x C 18.6900 -21.8400
14 C8x C 19.9500 -22.5400
15 C1b C 22.3300 -18.3400
16 C1b C 23.5900 -17.6400
17 C1b C 23.5900 -16.1700
18 N1y N 24.7800 -15.4700
19 C1x C 25.9700 -16.1700
20 C1x C 27.2300 -15.4700
21 N1y N 27.2300 -14.0700
22 C1x C 25.9700 -13.3700
23 C1x C 24.7800 -14.0700
24 C1a C 28.4200 -13.3700
25 S4a S 27.2300 -19.7400
26 N1c N 28.4200 -20.4400
27 O3c O 28.1400 -18.7600
28 O3c O 26.1800 -18.7600
29 C1a C 29.6100 -19.7400
30 C1a C 28.4200 -21.8400
BOND 33
1 17 18 1
2 6 7 1
3 7 8 2
4 8 3 1
5 2 10 1
6 18 19 1
7 19 20 1
8 20 21 1
9 21 22 1
10 22 23 1
11 23 18 1
12 21 24 1
13 9 1 1
14 1 4 1
15 9 10 2
16 10 11 1
17 11 12 2
18 12 13 1
19 13 14 2
20 14 9 1
21 3 2 1
22 2 15 1
23 3 4 2
24 15 16 1
25 4 5 1
26 16 17 1
27 5 6 2
28 7 25 1
29 25 26 1
30 25 27 2
31 25 28 2
32 26 29 1
33 26 30 1
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