Entry |
|
Name |
Dilevalol hydrochloride (JAN/USAN) |
Formula |
C19H24N2O3. HCl
|
Exact mass |
364.1554
|
Mol weight |
364.86
|
Structure |
|
Simcomp |
|
Efficacy |
Antihypertensive, beta-Adrenergic receptor antagonist |
Target |
|
Pathway |
hsa04080 | Neuroactive ligand-receptor interaction |
hsa04261 | Adrenergic signaling in cardiomyocytes |
|
Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Adrenaline
ADRB
D01906 Dilevalol hydrochloride (JAN/USAN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 25
1 C8y C 13.1600 -15.8200
2 C8y C 13.1600 -14.4200
3 C8x C 14.3500 -13.7200
4 C8x C 15.6100 -14.4200
5 C8y C 15.6100 -15.8200
6 C8x C 14.3500 -16.5200
7 C1c C 16.8000 -16.5200
8 C1b C 18.0600 -15.8200
9 N1b N 19.2500 -16.5200
10 C1c C 20.4400 -15.8200
11 C1b C 21.7000 -16.5200
12 C1b C 22.8900 -15.8200
13 C8y C 24.0800 -16.5200
14 C5a C 11.9700 -16.5200
15 N1a N 10.7800 -15.8200
16 O5a O 11.9700 -17.9200
17 O1a O 11.9700 -13.7200
18 O1a O 16.8700 -17.9200
19 C1a C 20.4400 -14.4200
20 C8x C 25.3400 -15.8200
21 C8x C 26.5300 -16.5200
22 C8x C 26.5300 -17.9200
23 C8x C 25.3400 -18.6200
24 C8x C 24.0800 -17.9200
25 X Cl 25.9000 -13.7900
BOND 25
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 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 1 14 1
15 14 15 1
16 14 16 2
17 2 17 1
18 7 18 1 #Down
19 10 19 1 #Down
20 13 20 2
21 20 21 1
22 21 22 2
23 22 23 1
24 23 24 2
25 13 24 1
|