| Entry |
|
|---|
| Name |
Metoquizine (USAN/INN) |
|---|
| Formula |
C22H27N5O
|
|---|
| Exact mass |
377.2216
|
|---|
| Mol weight |
377.48
|
|---|
| 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
D05012 Metoquizine (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 C1y C 30.9741 -17.3583
2 C8y C 29.7999 -18.0464
3 C1y C 32.1540 -18.0408
4 C1x C 30.9741 -15.9932
5 C8y C 29.7999 -19.4115
6 C8x C 28.6142 -17.3639
7 N1y N 33.3340 -17.3583
8 C1x C 32.1599 -19.4058
9 C1y C 32.1540 -15.3165
10 C8y C 30.9741 -20.0884
11 C8y C 28.6142 -20.0884
12 C8x C 27.4400 -18.0464
13 C1x C 33.3340 -15.9932
14 C1a C 34.5082 -18.0349
15 N1b N 32.1424 -13.9514
16 C8x C 30.9741 -21.4534
17 N4y N 28.6142 -21.4534
18 C8x C 27.4342 -19.4115
19 C5a C 33.3224 -13.2689
20 O5a O 33.3166 -11.9040
21 N4y N 34.4966 -13.9457
22 C1a C 27.5697 -22.4979
23 N5x N 34.4848 -15.3340
24 C8y C 35.8035 -15.7732
25 C8x C 36.6287 -14.6546
26 C8y C 35.8200 -13.5243
27 C1a C 36.2173 -17.0802
28 C1a C 36.2549 -12.2183
BOND 32
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 17 22 1
26 21 23 1
27 23 24 2
28 24 25 1
29 25 26 2
30 21 26 1
31 24 27 1
32 26 28 1
|
|---|
