| Entry |
|
|---|
| Name |
Vixotrigine (USAN/INN);
Raxatrigine |
|---|
| Formula |
C18H19FN2O2
|
|---|
| Exact mass |
314.1431
|
|---|
| Mol weight |
314.35
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Remark |
|
|---|
| Efficacy |
Analgesic, Sodium channel blocker |
|---|
| Comment |
Treatment of neuropathic pain
|
|---|
| Target |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Ion channels
Voltage-gated ion channels
Sodium channels
SCN9A
D11179 Vixotrigine (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 23
1 C1y C 4.7600 -18.9000
2 C1x C 5.1800 -20.2300
3 C1x C 6.5800 -20.2300
4 C1y C 7.0000 -18.9000
5 N1x N 5.8800 -18.0600
6 C5a C 3.5700 -18.2000
7 N1a N 2.3800 -18.9000
8 O5a O 3.5700 -16.8000
9 C8x C 8.1900 -16.8000
10 C8y C 8.1900 -18.2000
11 C8x C 9.3800 -18.9000
12 C8x C 10.6400 -18.2000
13 C8y C 10.6400 -16.8000
14 C8x C 9.3800 -16.1000
15 O2a O 11.8466 -16.0900
16 C1b C 13.0563 -16.7753
17 C8y C 14.2766 -16.0570
18 C8x C 15.4858 -16.7413
19 C8x C 16.6922 -16.0309
20 C8x C 16.6801 -14.6310
21 C8x C 15.4709 -13.9466
22 C8y C 14.2645 -14.6570
23 X F 13.0465 -13.9678
BOND 25
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1 #Up
7 6 7 1
8 6 8 2
9 9 10 2
10 10 11 1
11 11 12 2
12 12 13 1
13 13 14 2
14 9 14 1
15 4 10 1 #Up
16 13 15 1
17 15 16 1
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 20 21 1
23 21 22 2
24 17 22 1
25 22 23 1
|
|---|
