| Entry |
|
|---|
| Name |
Imitrodast sodium (JAN);
RS 5186 |
|---|
| Formula |
C13H11N2O2S. Na
|
|---|
| Exact mass |
282.0439
|
|---|
| Mol weight |
282.30
|
|---|
| Structure |
|
|---|
| Class |
Anti-allergic agent
DG01517 Thromboxane A2 receptor antagonist
|
|---|
| Efficacy |
Antiasthmatic, Thromboxane A2 (TXA2) receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Anti-allergic agent
DG01517 Thromboxane A2 receptor antagonist
D09774 Imitrodast sodium
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Thromboxane
TBXA2R
D09774 Imitrodast sodium (JAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 19
1 C2y C 15.2600 -20.4400
2 C1x C 15.2600 -21.8400
3 C1x C 16.4724 -22.5400
4 C8y C 17.6849 -21.8400
5 C8y C 17.6849 -20.4400
6 C2x C 16.4724 -19.7400
7 C8x C 19.0164 -22.2726
8 C8y C 19.8393 -21.1400
9 S2x S 19.0164 -20.0074
10 C6a C 14.0476 -19.7400
11 O6a O 12.8521 -20.4304 #-
12 O6a O 14.0475 -18.3402
13 C1b C 21.2100 -21.1400
14 N4y N 21.9100 -19.9276
15 C8x C 23.3100 -19.9276
16 C8x C 23.7426 -18.5961
17 N5x N 22.6100 -17.7732
18 C8x C 21.4774 -18.5961
19 Z Na 10.7100 -20.4400 #+
BOND 20
1 1 2 1
2 2 3 1
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 5 9 1
11 1 10 1
12 10 11 1
13 10 12 2
14 8 13 1
15 13 14 1
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 14 18 1
|
|---|
