| Entry |
|
|---|
| Name |
Brifentanil hydrochloride (USAN) |
|---|
| Formula |
C20H29FN6O3. HCl
|
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| Exact mass |
456.2052
|
|---|
| Mol weight |
456.94
|
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| Structure |
|
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| Simcomp |
|
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| Class |
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
Analgesic
DG01984 Opioid analgesics
|
|---|
| Efficacy |
Analgesic (narcotic), Opioid receptor agonist |
|---|
| Comment |
Phenylpiperidine derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
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| Interaction |
|
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| Structure map |
| map07224 | Opioid receptor agonists/antagonists |
|
|---|
| Brite |
Drug groups [BR:br08330]
Neuropsychiatric agent
DG01564 Opioid receptor agonist
DG01563 mu-Opioid receptor agonist
D03156 Brifentanil hydrochloride
Analgesic
DG01984 Opioid analgesics
D03156 Brifentanil hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Opioid
OPRM1
D03156 Brifentanil hydrochloride (USAN)
|
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 31
1 X Cl 31.9900 -25.9000
2 C8x C 15.9600 -27.4400
3 C8x C 15.9600 -28.8400
4 C8x C 17.1500 -29.5400
5 C8x C 18.4100 -28.8400
6 C8y C 18.4100 -27.4400
7 C8y C 17.1500 -26.7400
8 N1c N 19.6000 -26.7400
9 C1y C 20.8600 -27.4400
10 C1y C 20.8600 -28.8400
11 C1x C 22.0500 -29.5400
12 N1y N 23.2400 -28.8400
13 C1x C 23.2400 -27.4400
14 C1x C 22.0500 -26.7400
15 C1b C 24.5000 -29.5400
16 C1b C 25.6900 -28.8400
17 N4y N 26.8800 -29.5400
18 N5x N 27.2300 -30.8700
19 N5x N 28.6300 -30.8700
20 N4y N 29.1200 -29.6100
21 C8y C 28.0000 -28.7700
22 C5a C 19.6000 -25.3400
23 O5a O 18.4100 -24.6400
24 C1b C 20.8600 -24.6400
25 O2a O 22.0500 -25.3400
26 O5x O 28.0000 -27.3700
27 C1b C 30.3100 -28.9100
28 C1a C 31.5000 -29.6100
29 C1a C 19.6447 -29.5351
30 C1a C 23.2681 -24.6499
31 X F 17.1328 -25.3401
BOND 32
1 2 3 2
2 3 4 1
3 4 5 2
4 5 6 1
5 6 7 2
6 2 7 1
7 6 8 1
8 9 8 1 #Down
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 9 14 1
15 12 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 18 19 2
20 19 20 1
21 20 21 1
22 17 21 1
23 8 22 1
24 22 23 2
25 22 24 1
26 24 25 1
27 21 26 2
28 27 28 1
29 27 20 1
30 10 29 1 #Down
31 25 30 1
32 7 31 1
|
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