| Entry |
|
|---|
| Name |
Icotidine (USAN) |
|---|
| Formula |
C21H25N5O2
|
|---|
| Exact mass |
379.2008
|
|---|
| Mol weight |
379.4555
|
|---|
| Structure |
|
|---|
| Class |
Anti-allergic agent
DG01557 Histamine receptor antagonist
DG01482 Histamine receptor H1 antagonist
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01481 Histamine receptor H2 antagonist
|
|---|
| Efficacy |
Antihistaminic, H1 and H2 receptor antagonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
| hsa04750 | Inflammatory mediator regulation of TRP channels |
|
|---|
| Interaction |
|
|---|
| Brite |
Drug groups [BR:br08330]
Anti-allergic agent
DG01557 Histamine receptor antagonist
DG01482 Histamine receptor H1 antagonist
D04494 Icotidine
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01481 Histamine receptor H2 antagonist
D04494 Icotidine
Target-based classification of drugs [BR:br08310]
G Protein-coupled receptors
Rhodopsin family
Histamine
HRH1
D04494 Icotidine (USAN)
HRH2
D04494 Icotidine (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 C8x C 12.3200 -8.8200
2 C8x C 12.3200 -10.2200
3 C8y C 13.5324 -10.9200
4 C8y C 14.7449 -10.2200
5 N5x N 14.7449 -8.8200
6 C8x C 13.5324 -8.1200
7 O2a O 13.5324 -12.3198
8 C1a C 12.3032 -13.0297
9 C1b C 15.9760 -10.9310
10 C1b C 17.1812 -10.2353
11 C1b C 18.3635 -10.9181
12 C1b C 19.5575 -10.2288
13 N1b N 20.7454 -10.9148
14 C8y C 21.9365 -10.2271
15 N5x N 23.1259 -10.9139
16 C8y C 24.3384 -10.2140
17 C8y C 24.3385 -8.8140
18 C8x C 23.1491 -8.1272
19 N4x N 21.9366 -8.8271
20 O5x O 25.5695 -10.9250
21 C1b C 25.5644 -8.1062
22 C8y C 26.7719 -8.8034
23 C8x C 26.7723 -10.2196
24 C8x C 27.9849 -10.9193
25 C8y C 29.1971 -10.2190
26 N5x N 29.1968 -8.8027
27 C8x C 27.9841 -8.1031
28 C1a C 30.4048 -10.9159
BOND 30
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 1
9 4 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 2
16 15 16 1
17 16 17 1
18 17 18 2
19 18 19 1
20 14 19 1
21 16 20 2
22 17 21 1
23 22 23 2
24 23 24 1
25 24 25 2
26 25 26 1
27 26 27 2
28 22 27 1
29 21 22 1
30 25 28 1
|
|---|
