| Entry |
|
|---|
| Name |
Funapide (USAN/INN) |
|---|
| Formula |
C22H14F3NO5
|
|---|
| Exact mass |
429.0824
|
|---|
| Mol weight |
429.34
|
|---|
| Structure |
|
|---|
| 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
D11156 Funapide (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 31
1 C8y C 23.4500 -16.1700
2 C8y C 23.4500 -17.5700
3 C8x C 24.6400 -18.2700
4 C8x C 25.9000 -17.5700
5 C8x C 25.9000 -16.1700
6 C8x C 24.6400 -15.4700
7 C1z C 22.1200 -15.7500
8 C5x C 21.2800 -16.8700
9 N1y N 22.1200 -17.9900
10 C8y C 20.7900 -13.9300
11 C8y C 20.7900 -15.3300
12 C1x C 22.9600 -14.6300
13 O2x O 22.1200 -13.5100
14 O5x O 19.8800 -16.8700
15 C1b C 22.1200 -19.3900
16 C8y C 20.9076 -20.0900
17 O2x O 19.7808 -19.2905
18 C8y C 18.6762 -20.1168
19 C8x C 19.1207 -21.4227
20 C8x C 20.5001 -21.4034
21 C1d C 17.3442 -19.7044
22 C8x C 19.5776 -13.2300
23 C8y C 18.3651 -13.9300
24 C8y C 18.3651 -15.3300
25 C8x C 19.5776 -16.0300
26 O2x O 17.0336 -13.4974
27 C1x C 16.2107 -14.6300
28 O2x O 17.0336 -15.7626
29 X F 15.9919 -19.3420
30 X F 18.0442 -18.4919
31 X F 16.6442 -20.9168
BOND 36
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 1 7 1
8 7 8 1
9 8 9 1
10 2 9 1
11 10 11 1
12 7 11 1 #Down
13 7 12 1 #Up
14 12 13 1
15 10 13 1
16 8 14 2
17 9 15 1
18 15 16 1
19 16 17 1
20 17 18 1
21 18 19 2
22 19 20 1
23 16 20 2
24 18 21 1
25 10 22 2
26 22 23 1
27 23 24 2
28 24 25 1
29 11 25 2
30 23 26 1
31 26 27 1
32 27 28 1
33 24 28 1
34 21 29 1
35 21 30 1
36 21 31 1
|
|---|
