| Entry |
|
|---|
| Name |
Metalol hydrochloride (USAN) |
|---|
| Formula |
C11H18N2O3S. HCl
|
|---|
| Exact mass |
294.0805
|
|---|
| Mol weight |
294.80
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Efficacy |
beta-Adrenergic receptor antagonist |
|---|
| Comment |
Anti-adrenergic (beta-receptor)
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB2
D04953 Metalol hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 18
1 C8y C 22.2423 -19.0938
2 C1c C 23.4311 -19.7931
3 C8x C 22.2423 -17.6253
4 C8x C 20.9836 -19.7931
5 C1c C 24.6198 -19.0938
6 O1a O 23.4311 -21.1916
7 C8x C 20.9836 -16.9260
8 C8x C 19.8648 -19.0938
9 N1b N 25.8785 -19.7931
10 C8y C 19.8648 -17.6253
11 C1a C 27.0673 -19.0938
12 N1b N 18.6759 -16.9260
13 S4a S 17.4173 -17.6253
14 C1a C 16.2284 -16.9260
15 O3c O 18.6759 -18.3945
16 O3c O 16.3683 -18.3945
17 C1a C 24.6730 -17.7105
18 X Cl 30.7300 -20.3700
BOND 17
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 1
8 5 9 1
9 7 10 1
10 9 11 1
11 10 12 1
12 12 13 1
13 13 14 1
14 13 15 2
15 13 16 2
16 8 10 2
17 5 17 1
|
|---|
