| Entry |
|
|---|
| Name |
Clemizole hydrochloride (JAN/USAN);
Allercur (TN);
Reactrol (TN) |
|---|
| Formula |
C19H20ClN3. HCl
|
|---|
| Exact mass |
361.1113
|
|---|
| Mol weight |
362.29
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Efficacy |
Antiallergic, Anticonvulsant, TRP channel inhibitor |
|---|
| Comment |
Treatment of convulsions in Dravet syndrome and Lennox-Gastaut syndrome
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Ion channels
Voltage-gated ion channels
Transient receptor potential channels
TRPC5
D01705 Clemizole hydrochloride (JAN/USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 24
1 C8x C 22.3879 -17.2784
2 C8x C 23.5779 -17.9657
3 C8y C 24.7955 -17.2630
4 C8y C 24.7957 -15.8573
5 C8x C 23.6057 -15.1700
6 C8x C 22.3881 -15.8726
7 N5x N 26.1324 -17.6977
8 C8y C 26.9589 -16.5606
9 N4y N 26.1328 -15.4231
10 C1b C 28.3330 -16.5609
11 N1y N 29.0350 -15.3456
12 C1b C 26.1328 -14.0231
13 C8y C 24.9203 -13.3231
14 C8x C 24.9203 -11.9000
15 C8x C 23.7079 -11.2000
16 C8y C 22.4955 -11.9000
17 C8x C 22.4955 -13.3231
18 C8x C 23.7079 -14.0231
19 X Cl 21.2641 -11.1888
20 C1x C 30.4350 -15.3456
21 C1x C 30.8676 -14.0141
22 C1x C 29.7350 -13.1912
23 C1x C 28.6023 -14.0141
24 X Cl 30.8700 -17.4300
BOND 26
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 3 7 1
8 7 8 2
9 8 9 1
10 4 9 1
11 8 10 1
12 10 11 1
13 9 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 16 19 1
22 11 20 1
23 20 21 1
24 21 22 1
25 22 23 1
26 11 23 1
|
|---|
