| Entry |
|
|---|
| Name |
Celiprolol hydrochloride (JAN/USAN);
Selectol (TN) |
|---|
| Formula |
C20H33N3O4. HCl
|
|---|
| Exact mass |
415.2238
|
|---|
| Mol weight |
415.9547
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01464 beta-Adrenergic receptor antagonist (Beta blocker)
DG01461 beta1-Adrenergic receptor antagonist
DG03231 Antihypertensive
|
|---|
| Remark |
| Therapeutic category: | 2149 |
| Product (DG00317): | D01741<JP> |
|
|---|
| Efficacy |
Antihypertensive, Vasodilator, beta1-Adrenergic receptor antagonist |
|---|
| Comment |
Propranolol derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
| hsa04261 | Adrenergic signaling in cardiomyocytes |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
C CARDIOVASCULAR SYSTEM
C07 BETA BLOCKING AGENTS
C07A BETA BLOCKING AGENTS
C07AB Beta blocking agents, selective
C07AB08 Celiprolol
D01741 Celiprolol hydrochloride (JAN/USAN) <JP>
Therapeutic category of drugs in Japan [BR:br08301]
2 Agents affecting individual organs
21 Cardiovascular agents
214 Antihypertensives
2149 Others
D01741 Celiprolol hydrochloride (JAN/USAN)
Drug groups [BR:br08330]
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01464 beta-Adrenergic receptor antagonist (Beta blocker)
DG01461 beta1-Adrenergic receptor antagonist
DG00317 Celiprolol
D01741 Celiprolol hydrochloride
DG03231 Antihypertensive
DG00317 Celiprolol
D01741 Celiprolol hydrochloride
Drug classes [BR:br08332]
Cardiovascular agent
DG03231 Antihypertensive
D01741 Celiprolol hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB1
D01741 Celiprolol hydrochloride (JAN/USAN) <JP>
Drug groups [BR:br08330]
Cardiovascular agent
DG01466 Adrenergic receptor antagonist
DG01464 beta-Adrenergic receptor antagonist (Beta blocker)
DG01461 beta1-Adrenergic receptor antagonist
DG00317 Celiprolol
DG03231 Antihypertensive
DG00317 Celiprolol
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 28
1 C8y C 25.8368 -14.5800
2 C8y C 24.6508 -15.2776
3 C8x C 27.0925 -15.2776
4 O2a O 25.8368 -13.1848
5 C5a C 23.4648 -14.6498
6 C8x C 27.0925 -16.6729
7 C1b C 27.0227 -12.4871
8 C8y C 25.9065 -17.3705
9 C1a C 22.2788 -15.3474
10 O5a O 23.4648 -13.2545
11 C1c C 28.2785 -13.1848
12 N1b N 25.9065 -18.8356
13 C1b C 29.4644 -12.4174
14 O1a O 28.2785 -14.5800
15 C5a C 24.7205 -19.5332
16 N1b N 30.7202 -13.1150
17 N1c N 23.4648 -18.9053
18 O5a O 24.7205 -20.9285
19 C1d C 31.9759 -12.4174
20 C1b C 22.3486 -19.6030
21 C1a C 21.0929 -18.9053
22 C1a C 33.1619 -11.7197
23 C1b C 23.4648 -17.4403
24 C8x C 24.6508 -16.6729
25 C1a C 22.2788 -16.7427
26 C1a C 32.6627 -13.6178
27 C1a C 31.2725 -11.1878
28 X Cl 30.8597 -19.1146
BOND 27
1 2 24 2
2 2 5 1
3 3 6 1
4 4 7 1
5 24 8 1
6 5 9 1
7 5 10 2
8 7 11 1
9 8 12 1
10 11 13 1
11 11 14 1
12 12 15 1
13 13 16 1
14 15 17 1
15 15 18 2
16 16 19 1
17 17 20 1
18 20 21 1
19 6 8 2
20 19 22 1
21 17 23 1
22 1 2 1
23 1 3 2
24 23 25 1
25 1 4 1
26 19 26 1
27 19 27 1
|
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