| Entry |
|
|---|
| Name |
Barbexaclone (INN);
Maliasin (TN) |
|---|
| Formula |
C12H12N2O3. C10H21N
|
|---|
| Exact mass |
387.2522
|
|---|
| Mol weight |
387.5157
|
|---|
| Structure |
|
|---|
| Component |
Phenobarbital [DR: D00506], Levopropylhexedrine
|
|---|
| Class |
Neuropsychiatric agent
DG01904 Barbiturate antiepileptics
|
|---|
| Remark |
|
|---|
| Efficacy |
Antiepileptic |
|---|
| Comment |
Barbiturate derivative
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
N NERVOUS SYSTEM
N03 ANTIEPILEPTICS
N03A ANTIEPILEPTICS
N03AA Barbiturates and derivatives
N03AA04 Barbexaclone
D07298 Barbexaclone (INN)
Target-based classification of drugs [BR:br08310]
Ion channels
Ligand-gated ion channels
GABA (ionotropic)
GABR
D07298 Barbexaclone (INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 N1x N 19.0113 -18.7352
2 C5x C 19.0113 -20.1329
3 N1x N 20.2216 -20.8317
4 C5x C 21.4321 -20.1329
5 C1z C 21.4321 -18.7352
6 C5x C 20.2216 -18.0364
7 O5x O 20.2216 -16.6390
8 O5x O 17.8010 -20.8317
9 O5x O 22.6610 -20.8426
10 C8y C 22.6610 -18.0255
11 C8x C 23.8642 -18.7200
12 C8x C 25.0744 -18.0211
13 C8x C 25.0743 -16.6235
14 C8x C 23.8713 -15.9289
15 C8x C 22.6609 -16.6278
16 C1b C 22.6611 -19.4449
17 C1a C 24.0588 -19.4449
18 C1x C 28.7946 -18.7352
19 C1x C 28.7946 -20.1329
20 C1x C 30.0049 -20.8317
21 C1x C 31.2153 -20.1329
22 C1y C 31.2153 -18.7352
23 C1x C 30.0049 -18.0364
24 C1b C 32.4507 -18.0364
25 C1c C 33.6611 -18.7352
26 N1b N 34.8715 -18.0364
27 C1a C 36.0818 -18.7352
28 C1a C 33.6611 -20.1327
BOND 29
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 6 7 2
8 2 8 2
9 4 9 2
10 5 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 13 14 1
15 14 15 2
16 10 15 1
17 5 16 1
18 16 17 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 22 23 1
24 18 23 1
25 22 24 1
26 24 25 1
27 25 26 1 #Up
28 26 27 1
29 25 28 1
|
|---|
