| Entry |
|
|---|
| Name |
Etintidine hydrochloride (USAN) |
|---|
| Formula |
C12H16N6S. HCl
|
|---|
| Exact mass |
312.0924
|
|---|
| Mol weight |
312.82
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01481 Histamine receptor H2 antagonist
|
|---|
| Efficacy |
Anti-ulcerative, H2 receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01481 Histamine receptor H2 antagonist
D04098 Etintidine hydrochloride
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Histamine
HRH2
D04098 Etintidine hydrochloride (USAN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 20
1 C8y C 25.1582 -16.0686
2 C8y C 23.8345 -16.4891
3 N5x N 25.1648 -14.6605
4 C1b C 26.3748 -16.7648
5 N4x N 23.0138 -15.3604
6 C1a C 23.3926 -17.8184
7 C8x C 23.8349 -14.2244
8 S2a S 27.5857 -16.0686
9 C1b C 28.7964 -16.7648
10 C1b C 30.0071 -16.0686
11 N1b N 31.2178 -16.7648
12 C2c C 32.4345 -16.0686
13 N2b N 32.4345 -14.6650
14 N1b N 33.6452 -16.7648
15 C3b C 33.6452 -13.9688
16 C1b C 34.8561 -16.0686
17 N3a N 34.8710 -13.2739
18 C3b C 36.0743 -16.7747
19 C3a C 37.2863 -17.4745
20 X Cl 39.6796 -15.3946
BOND 19
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 2
13 12 14 1
14 13 15 1
15 14 16 1
16 5 7 1
17 15 17 3
18 16 18 1
19 18 19 3
|
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