| Entry |
|
|---|
| Name |
Zuclopenthixol decanoate;
Clopixol depot (TN) |
|---|
| Formula |
C32H43ClN2O2S
|
|---|
| Exact mass |
554.2734
|
|---|
| Mol weight |
555.214
|
|---|
| 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
D08692 Zuclopenthixol decanoate
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG00896 Zuclopenthixol
D08692 Zuclopenthixol decanoate
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00896 Zuclopenthixol
D08692 Zuclopenthixol decanoate
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD1
D08692 Zuclopenthixol decanoate
DRD2
D08692 Zuclopenthixol decanoate
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D08692
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG00896 Zuclopenthixol
Metabolizing enzyme substrate
DG01644 CYP2D6 substrate
DG00896 Zuclopenthixol
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 38
1 C8x C 12.0400 -20.3700
2 C8x C 12.0400 -21.7700
3 C8x C 13.3000 -22.4700
4 C8y C 14.4900 -21.7700
5 C8y C 14.4900 -20.3700
6 C8x C 13.3000 -19.6700
7 S2x S 15.6800 -22.4700
8 C8y C 16.9400 -21.7700
9 C8y C 16.9400 -20.3700
10 C8y C 15.6800 -19.6700
11 C8x C 18.1300 -22.4700
12 C8x C 19.3200 -21.7700
13 C8y C 19.3200 -20.3700
14 C8x C 18.1300 -19.6700
15 C2b C 15.6800 -18.2700
16 C1b C 16.9400 -17.5700
17 C1b C 16.9400 -16.1700
18 N1y N 18.1300 -15.4700
19 C1x C 19.3200 -16.1700
20 C1x C 20.5100 -15.4700
21 N1y N 20.5100 -14.0700
22 C1x C 19.3200 -13.3700
23 C1x C 18.1300 -14.0700
24 C1b C 21.7700 -13.3700
25 C1b C 22.9600 -14.0700
26 O7a O 24.1500 -13.3700
27 X Cl 20.5800 -19.6700
28 C7a C 25.4100 -14.0700
29 C1b C 26.5300 -13.3700
30 O6a O 25.4100 -15.4700
31 C1b C 27.7200 -14.0700
32 C1b C 28.9800 -13.3700
33 C1b C 30.1700 -14.0700
34 C1b C 31.3600 -13.3700
35 C1b C 32.6200 -14.0700
36 C1b C 33.8100 -13.3700
37 C1b C 35.0000 -14.0700
38 C1a C 36.2600 -13.3700
BOND 41
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
34 29 31 1
35 31 32 1
36 32 33 1
37 33 34 1
38 34 35 1
39 35 36 1
40 36 37 1
41 37 38 1
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