| Entry |
|
|---|
| Name |
Zuclopenthixol acetate;
Cisordinol-acutard (TN) |
|---|
| Formula |
C24H27ClN2O2S
|
|---|
| Exact mass |
442.1482
|
|---|
| Mol weight |
443.0014
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
|
|---|
| Remark |
|
|---|
| Efficacy |
Antipsychotic, Neuroleptic, Dopamine receptor antagonist |
|---|
| Comment |
Thioxanthene derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Metabolism |
Enzyme: CYP2D6 [HSA: 1565]
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AF Thioxanthene derivatives
N05AF05 Zuclopenthixol
D08691 Zuclopenthixol acetate
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG00896 Zuclopenthixol
D08691 Zuclopenthixol acetate
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00896 Zuclopenthixol
D08691 Zuclopenthixol acetate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD1
D08691 Zuclopenthixol acetate
DRD2
D08691 Zuclopenthixol acetate
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08691
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG00896 Zuclopenthixol
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00896 Zuclopenthixol
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C8x C 19.1182 -20.7993
2 C8x C 19.1182 -22.1999
3 C8x C 20.3788 -22.9002
4 C8y C 21.5693 -22.1999
5 C8y C 21.5693 -20.7993
6 C8x C 20.3788 -20.0989
7 S2x S 22.7599 -22.9002
8 C8y C 24.0205 -22.1999
9 C8y C 24.0205 -20.7993
10 C8y C 22.7599 -20.0989
11 C8x C 25.2110 -22.9002
12 C8x C 26.4015 -22.1999
13 C8y C 26.4015 -20.7993
14 C8x C 25.2110 -20.0989
15 C2b C 22.7599 -18.6983
16 C1b C 24.0205 -17.9980
17 C1b C 24.0205 -16.5973
18 N1y N 25.2110 -15.8970
19 C1x C 26.4015 -16.5973
20 C1x C 27.5921 -15.8970
21 N1y N 27.5921 -14.4964
22 C1x C 26.4015 -13.7961
23 C1x C 25.2110 -14.4964
24 C1b C 28.8527 -13.7961
25 C1b C 30.0432 -14.4964
26 O7a O 31.2337 -13.7961
27 X Cl 27.6621 -20.0989
28 C7a C 32.4524 -14.4865
29 C1a C 33.6343 -13.7911
30 O6a O 32.4641 -15.8964
BOND 33
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 8 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 9 14 1
17 10 15 2
18 15 16 1
19 16 17 1
20 17 18 1
21 18 19 1
22 19 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 18 23 1
27 21 24 1
28 24 25 1
29 25 26 1
30 13 27 1
31 26 28 1
32 28 29 1
33 28 30 2
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