| Entry |
|
|---|
| Name |
Sulukast (USAN/INN) |
|---|
| Formula |
C25H36N4O3S
|
|---|
| Exact mass |
472.2508
|
|---|
| Mol weight |
472.65
|
|---|
| Structure |
|
|---|
| Class |
Anti-allergic agent
DG01541 Cysteinyl leukotriene receptor antagonist
|
|---|
| Efficacy |
Antiasthmatic, Leukotriene receptor antagonist |
|---|
| Comment |
Leukotriene analog
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Anti-allergic agent
DG01541 Cysteinyl leukotriene receptor antagonist
D02850 Sulukast
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Cysteinyl leukotriene
CYSLTR1
D02850 Sulukast (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 33
1 C8x C 21.6300 -16.9400
2 C8y C 21.6300 -18.3400
3 C8x C 22.8424 -19.0400
4 C8y C 24.0549 -18.3400
5 C8x C 24.0549 -16.9400
6 C8x C 22.8424 -16.2400
7 C8y C 20.4176 -19.0400
8 C1c C 25.2860 -19.0510
9 N5x N 19.1574 -18.4788
10 N5x N 18.2343 -19.5039
11 N5x N 18.9239 -20.6986
12 N4x N 20.2732 -20.4119
13 C1c C 26.4824 -18.3400
14 C2b C 27.6949 -19.0400
15 C2b C 28.9073 -18.3400
16 C2b C 30.1197 -19.0400
17 O1a O 25.2945 -20.4398
18 S2a S 26.4736 -16.9401
19 C1b C 27.6715 -16.2383
20 C1b C 28.8727 -16.9219
21 C6a C 30.0485 -16.2333
22 O6a O 31.2541 -16.9195
23 O6a O 30.0398 -14.8400
24 C2b C 31.5197 -19.0400
25 C1b C 32.7124 -18.3400
26 C1b C 33.9249 -19.0400
27 C1b C 35.1373 -18.3400
28 C1b C 36.3497 -19.0400
29 C1b C 37.5622 -18.3400
30 C1b C 38.7746 -19.0400
31 C1b C 39.9870 -18.3400
32 C1b C 41.1995 -19.0400
33 C1a C 42.4119 -18.3400
BOND 34
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 2 7 1
8 4 8 1
9 7 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 7 12 1
14 8 13 1
15 13 14 1
16 14 15 2
17 15 16 1
18 8 17 1 #Up
19 13 18 1 #Down
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 21 23 2
25 16 24 2
26 24 25 1
27 25 26 1
28 26 27 1
29 27 28 1
30 28 29 1
31 29 30 1
32 30 31 1
33 31 32 1
34 32 33 1
|
|---|
