| Entry |
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| Name |
Flupentixol dihydrochloride (JAN) |
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| Formula |
C23H25F3N2OS. 2HCl
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| Exact mass |
506.1173
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| Mol weight |
507.44
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| Structure |
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| Simcomp |
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| Class |
Neuropsychiatric agent
DG01478 Dopamine antagonist
|
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| Remark |
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| Efficacy |
Antipsychotic, Dopamine receptor antagonist |
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| Comment |
Thioxanthene derivative
|
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| Target |
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| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
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| Interaction |
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| Structure map |
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N05 PSYCHOLEPTICS
N05A ANTIPSYCHOTICS
N05AF Thioxanthene derivatives
N05AF01 Flupentixol
D02236 Flupentixol dihydrochloride (JAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG00893 Flupentixol
D02236 Flupentixol dihydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Dopamine
DRD1
D02236 Flupentixol dihydrochloride (JAN)
DRD2
D02236 Flupentixol dihydrochloride (JAN)
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01478 Dopamine antagonist
DG00893 Flupentixol
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 32
1 X Cl 28.0631 -17.6178
2 C8y C 14.0000 -17.9900
3 C8y C 14.0000 -19.3900
4 S2x S 15.2124 -20.0900
5 C8y C 16.4249 -19.3900
6 C8y C 16.4249 -17.9900
7 C8y C 15.2124 -17.2900
8 C8x C 17.6373 -20.0900
9 C8x C 18.8498 -19.3900
10 C8y C 18.8498 -17.9900
11 C8x C 17.6373 -17.2900
12 C8x C 12.7876 -17.2900
13 C8x C 11.5751 -17.9900
14 C8x C 11.5751 -19.3900
15 C8x C 12.7876 -20.0900
16 C2b C 15.1950 -15.8900
17 C1b C 16.4099 -15.1943
18 C1b C 16.4148 -13.7943
19 N1y N 17.6298 -13.0986
20 C1x C 18.8435 -13.8052
21 C1x C 20.0585 -13.1095
22 N1y N 20.0635 -11.7096
23 C1x C 18.8497 -11.0030
24 C1x C 17.6348 -11.6986
25 C1b C 21.3024 -10.9900
26 C1b C 22.5149 -11.6900
27 O1a O 23.7273 -10.9900
28 C1d C 20.0473 -17.2985
29 X F 21.2597 -16.5985
30 X F 20.7473 -18.5109
31 X F 19.3473 -16.0860
32 X Cl 28.0631 -17.6178
BOND 33
1 2 3 2
2 3 4 1
3 4 5 1
4 5 6 2
5 6 7 1
6 2 7 1
7 5 8 1
8 8 9 2
9 9 10 1
10 10 11 2
11 6 11 1
12 2 12 1
13 12 13 2
14 13 14 1
15 14 15 2
16 3 15 1
17 7 16 2
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 19 24 1
27 22 25 1
28 25 26 1
29 26 27 1
30 10 28 1
31 28 29 1
32 28 30 1
33 28 31 1
BRACKET 1 26.3900 -18.8300 26.3900 -16.3800
1 28.9800 -16.3800 28.9800 -18.8300
1 2
ORIGINAL 1 1
REPEAT 1 32
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