| Entry |
|
|---|
| Name |
Ritolukast (USAN/INN) |
|---|
| Formula |
C17H13F3N2O3S
|
|---|
| Exact mass |
382.0599
|
|---|
| Mol weight |
382.36
|
|---|
| Structure |
|
|---|
| Class |
Anti-allergic agent
DG01541 Cysteinyl leukotriene receptor antagonist
|
|---|
| Efficacy |
Antiasthmatic, Leukotriene receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Anti-allergic agent
DG01541 Cysteinyl leukotriene receptor antagonist
D02849 Ritolukast
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Cysteinyl leukotriene
CYSLTR1
D02849 Ritolukast (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 26
1 C8x C 22.3300 -15.4700
2 C8x C 22.3300 -14.0700
3 C8x C 23.5200 -13.3700
4 C8y C 24.7800 -14.0700
5 C8y C 24.7800 -15.4700
6 C8x C 23.5200 -16.1700
7 C8x C 25.9700 -13.3700
8 C8x C 27.1600 -14.0700
9 C8y C 27.1600 -15.4700
10 N5x N 25.9700 -16.1700
11 C1b C 28.3724 -16.1700
12 O2a O 29.5849 -15.4700
13 C8y C 30.7973 -16.1700
14 C8x C 30.7973 -17.5700
15 C8x C 32.0097 -18.2700
16 C8x C 33.2222 -17.5700
17 C8y C 33.2222 -16.1700
18 C8x C 32.0097 -15.4700
19 N1b N 34.4553 -15.4578
20 S4a S 35.6615 -16.1540
21 C1d C 36.8433 -15.4715
22 O3c O 34.6716 -17.1440
23 O3c O 36.6515 -17.1440
24 X F 35.8534 -14.4816
25 X F 37.8333 -16.4615
26 X F 37.8333 -14.4816
BOND 28
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 13 18 1
21 17 19 1
22 19 20 1
23 20 21 1
24 20 22 2
25 20 23 2
26 21 24 1
27 21 25 1
28 21 26 1
|
|---|
