| Entry |
|
|---|
| Name |
Toquizine (USAN) |
|---|
| Formula |
C23H29N5O
|
|---|
| Exact mass |
391.2372
|
|---|
| Mol weight |
391.5093
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Efficacy |
Anti-ulcerative, Muscarinic acetylcholine receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Acetylcholine (muscarinic)
CHRM
D06192 Toquizine (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 29
1 C1y C 31.1517 -17.8069
2 C8y C 29.9756 -18.4961
3 C1y C 32.3334 -18.4905
4 C1x C 31.1517 -16.4396
5 C8y C 29.9756 -19.8633
6 C8x C 28.7881 -17.8125
7 N1y N 33.5153 -17.8069
8 C1x C 32.3394 -19.8576
9 C1y C 32.3334 -15.7619
10 C8y C 31.1517 -20.5413
11 C8y C 28.7881 -20.5413
12 C8x C 27.6120 -18.4961
13 C1x C 33.5153 -16.4396
14 C1a C 34.6914 -18.4846
15 N1b N 32.3218 -14.3946
16 C8x C 31.1517 -21.9084
17 N4y N 28.7881 -21.9084
18 C8x C 27.6062 -19.8633
19 C5a C 33.5037 -13.7110
20 O5a O 33.4979 -12.3440
21 N4y N 34.6797 -14.3889
22 N5x N 34.6365 -15.7846
23 C8y C 35.9451 -16.2596
24 C8x C 36.8012 -15.1618
25 C8y C 36.0216 -14.0084
26 C1a C 36.3245 -17.5792
27 C1a C 36.4920 -12.7125
28 C1a C 26.3593 -21.9084
29 C1b C 27.5738 -22.6095
BOND 33
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 2
12 7 13 1
13 7 14 1
14 9 15 1 #Up
15 10 16 2
16 11 17 1
17 11 18 2
18 15 19 1
19 19 20 2
20 19 21 1
21 8 10 1
22 9 13 1
23 12 18 1
24 16 17 1
25 21 22 1
26 22 23 2
27 23 24 1
28 24 25 2
29 21 25 1
30 23 26 1
31 25 27 1
32 28 29 1
33 17 29 1
|
|---|
