| Entry |
|
|---|
| Name |
Solabegron hydrochloride (USAN) |
|---|
| Formula |
C23H23ClN2O3. HCl
|
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| Exact mass |
446.1164
|
|---|
| Mol weight |
447.35
|
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| Structure |
|
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| Class |
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01453 beta3-Adrenergic receptor agonist
|
|---|
| Efficacy |
Antidiabetic, Overactive bladder agent, beta3-Adrenergic receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Cardiovascular agent
DG01456 Adrenergic receptor agonist
DG01455 beta-Adrenergic receptor agonist
DG01453 beta3-Adrenergic receptor agonist
D05879 Solabegron hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB3
D05879 Solabegron hydrochloride (USAN)
|
|---|
| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 30
1 C8y C 15.3218 -19.6613
2 C8x C 15.3218 -18.2620
3 C8x C 16.5113 -17.5623
4 C8x C 17.7707 -18.2620
5 C8y C 17.7707 -19.6613
6 C8x C 16.5113 -20.3609
7 X Cl 14.1325 -20.3609
8 C1c C 18.9602 -20.3609
9 C1b C 20.1776 -19.6712
10 N1b N 21.3585 -20.3659
11 C1b C 22.5633 -19.6833
12 C1b C 23.7339 -20.3718
13 N1b N 24.9438 -19.6862
14 C8y C 26.1632 -20.4038
15 O1a O 18.9488 -21.7603
16 C8x C 26.1513 -21.8301
17 C8x C 27.3573 -22.5399
18 C8x C 28.5750 -21.8504
19 C8y C 28.5869 -20.4241
20 C8x C 27.3810 -19.7144
21 C8y C 29.8050 -19.6940
22 C8x C 31.0142 -20.3655
23 C8y C 32.2141 -19.6458
24 C8x C 32.1909 -18.2467
25 C8x C 30.9819 -17.5752
26 C8x C 29.8518 -18.2949
27 C6a C 33.4204 -20.3161
28 O6a O 34.6486 -19.5804
29 O6a O 33.3731 -21.6903
30 X Cl 36.9415 -21.6203
BOND 31
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 5 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 8 15 1 #Down
16 14 16 2
17 16 17 1
18 17 18 2
19 18 19 1
20 19 20 2
21 14 20 1
22 19 21 1
23 21 22 2
24 22 23 1
25 23 24 2
26 24 25 1
27 25 26 2
28 21 26 1
29 23 27 1
30 27 28 1
31 27 29 2
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