| Entry |
|
|---|
| Name |
Olgotrelvir sodium (USAN) |
|---|
| Formula |
C22H29N4O7S. Na
|
|---|
| Exact mass |
516.1655
|
|---|
| Mol weight |
516.54
|
|---|
| Structure |
|
|---|
| Class |
Antiviral
DG03174 Anti-SARS-CoV-2 agent
|
|---|
| Remark |
|
|---|
| Efficacy |
Antiviral |
|---|
| Comment |
Treatment of SARS-CoV-2 infection
|
|---|
| Target |
|
|---|
| Pathway |
| hsa04612 | Antigen processing and presentation |
| ko05171 | Coronavirus disease - COVID-19 |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antiviral
DG03174 Anti-SARS-CoV-2 agent
DG03293 Olgotrelvir
D12778 Olgotrelvir sodium
Target-based classification of drugs [BR:br08310]
Peptidases and inhibitors
Cysteine peptidases
Papain family
CTSL
D12778 Olgotrelvir sodium (USAN)
Antimicrobials [BR:br08307]
Antivirals
Polyprotein cleavage inhibitor
SARS-CoV 3C protease inhibitor
D12778 Olgotrelvir sodium (USAN)
Drug groups [BR:br08330]
Antiviral
DG03174 Anti-SARS-CoV-2 agent
DG03293 Olgotrelvir
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 35
1 N1b N 7.2181 -6.5874
2 C1c C 8.4094 -5.8866
3 C5a C 9.6708 -6.5874
4 N1b N 10.8621 -5.8866
5 O5a O 9.6708 -7.9889
6 C1b C 8.4094 -4.4850
7 C1c C 9.6708 -3.7842
8 C1a C 10.8621 -4.4850
9 C1a C 9.6708 -2.3126
10 C5a C 7.2181 -7.9889
11 C8y C 6.0267 -8.6897
12 O5a O 8.4094 -8.6897
13 C8x C 5.8866 -10.0212
14 C8y C 4.5551 -10.3015
15 C8y C 3.8543 -9.1102
16 N4x N 4.7653 -8.1291
17 C8x C 3.9244 -11.5629
18 C8x C 2.4527 -11.5629
19 C8x C 1.7520 -10.3015
20 C8x C 2.4527 -9.1102
21 C1c C 12.0536 -6.5874
22 C1c C 12.0536 -7.9889
23 C1b C 13.3150 -5.8866
24 C1y C 14.5063 -6.5874
25 C5x C 14.9968 -7.9188
26 N1x N 16.3984 -7.9188
27 C1x C 16.8189 -6.5874
28 C1x C 15.6976 -5.7464
29 O5x O 14.1559 -9.0401
30 O1a O 13.2449 -8.6897
31 S4a S 10.8621 -8.6897
32 O1d O 10.8621 -10.0913 #-
33 O1d O 9.6708 -9.3905
34 O1d O 12.0536 -9.3905
35 Z Na 8.7500 -11.6200 #+
BOND 36
1 1 2 1
2 2 3 1
3 3 4 1
4 3 5 2
5 2 6 1 #Up
6 6 7 1
7 7 8 1
8 7 9 1
9 1 10 1
10 10 11 1
11 10 12 2
12 11 13 2
13 13 14 1
14 14 15 1
15 15 16 1
16 11 16 1
17 14 17 2
18 17 18 1
19 18 19 2
20 19 20 1
21 15 20 2
22 21 4 1 #Up
23 21 22 1
24 21 23 1
25 24 23 1 #Down
26 24 25 1
27 25 26 1
28 26 27 1
29 27 28 1
30 24 28 1
31 25 29 2
32 22 30 1
33 22 31 1
34 31 32 1
35 31 33 2
36 31 34 2
|
|---|
