Entry |
|
Name |
Tegoprazan (INN) |
Formula |
C20H19F2N3O3
|
Exact mass |
387.1394
|
Mol weight |
387.38
|
Structure |
|
Class |
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01646 Proton pump inhibitor (PPI)
|
Remark |
|
Efficacy |
Anti-ulcerative, Proton pump inhibitor |
Target |
|
Pathway |
|
Interaction |
|
Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
A ALIMENTARY TRACT AND METABOLISM
A02 DRUGS FOR ACID RELATED DISORDERS
A02B DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
A02BC Proton pump inhibitors
A02BC09 Tegoprazan
D12246 Tegoprazan (INN)
Drug groups [BR:br08330]
Gastrointestinal agent
DG01975 Agents for peptic ulcer
DG01646 Proton pump inhibitor (PPI)
D12246 Tegoprazan
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
ATPase
ATP4
D12246 Tegoprazan (INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 28
1 C8y C 16.3100 -9.0300
2 C8x C 16.3100 -10.4300
3 C8y C 15.1200 -11.1300
4 C8y C 13.8600 -10.4300
5 C8y C 13.8600 -9.0300
6 C8x C 15.1200 -8.3300
7 N4x N 12.5300 -10.8500
8 C8y C 11.7600 -9.7300
9 N5x N 12.5300 -8.6100
10 C1a C 10.3600 -9.7300
11 C5a C 17.5000 -8.3300
12 N1c N 18.6900 -9.0300
13 O5a O 17.5000 -6.9300
14 C1a C 19.8800 -8.3300
15 C1a C 18.6900 -10.4300
16 O2a O 15.1200 -12.5300
17 C1y C 16.3100 -13.2300
18 C1x C 17.5000 -12.5300
19 C1x C 18.7600 -13.2300
20 O2x O 18.7600 -14.6300
21 C8y C 17.5700 -15.3300
22 C8y C 16.3100 -14.6300
23 C8x C 17.5700 -16.7300
24 C8y C 16.3100 -17.4300
25 C8x C 15.1200 -16.7300
26 C8y C 15.1200 -15.3300
27 X F 13.9300 -14.6300
28 X F 16.3100 -18.8300
BOND 31
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 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 8 10 1
12 1 11 1
13 11 12 1
14 11 13 2
15 12 14 1
16 12 15 1
17 3 16 1
18 17 16 1 #Up
19 17 18 1
20 18 19 1
21 19 20 1
22 20 21 1
23 21 22 1
24 17 22 1
25 21 23 2
26 23 24 1
27 24 25 2
28 25 26 1
29 22 26 2
30 26 27 1
31 24 28 1
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