| Entry |
|
|---|
| Name |
Elsulfavirine (INN) |
|---|
| Formula |
C24H17BrCl2FN3O5S
|
|---|
| Exact mass |
626.9433
|
|---|
| Mol weight |
629.28
|
|---|
| Structure |
|
|---|
| Class |
Antiviral
DG01889 Non-nucleoside reverse transcriptase inhibitor (NNRTI)
DG03107 Anti-HIV agent
DG01656 HIV reverse transcriptase inhibitor
|
|---|
| Remark |
|
|---|
| Efficacy |
Antiviral, Reverse transcriptase inhibitor |
|---|
| Target |
HIV-1 reverse transcriptase [KO: K24802] |
|---|
| Pathway |
| ko03260 | Virion - Human immunodeficiency virus |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
J ANTIINFECTIVES FOR SYSTEMIC USE
J05 ANTIVIRALS FOR SYSTEMIC USE
J05A DIRECT ACTING ANTIVIRALS
J05AG Non-nucleoside reverse transcriptase inhibitors
J05AG07 Elsulfavirine
D13018 Elsulfavirine (INN)
Drug groups [BR:br08330]
Antiviral
DG01889 Non-nucleoside reverse transcriptase inhibitor (NNRTI)
D13018 Elsulfavirine
DG03107 Anti-HIV agent
DG01656 HIV reverse transcriptase inhibitor
D13018 Elsulfavirine
Antimicrobials [BR:br08307]
Antivirals
Genome replication inhibitor
HIV reverse transcriptase inhibitor
D13018 Elsulfavirine (INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 37
1 C8x C 27.7200 -22.3300
2 C8y C 27.7200 -20.9300
3 C8x C 26.5300 -20.2300
4 C8y C 25.2700 -20.9300
5 C8x C 25.2700 -22.3300
6 C8y C 26.5300 -23.0300
7 C3b C 28.9100 -20.2300
8 N3a N 30.1700 -19.5300
9 X Cl 26.5300 -24.4300
10 O2a O 24.0800 -20.2300
11 C8y C 22.8900 -20.9300
12 C8y C 21.7000 -20.2300
13 C8y C 20.4400 -20.9300
14 C8x C 20.4400 -22.3300
15 C8x C 21.6300 -23.0300
16 C8y C 22.8900 -22.3300
17 X F 21.7000 -18.8300
18 X Br 24.0800 -23.0300
19 C1b C 19.2500 -20.2300
20 C5a C 18.0600 -20.9300
21 N1b N 16.8700 -20.2300
22 O5a O 18.0600 -22.3300
23 C8y C 15.6800 -20.9300
24 C8x C 14.4900 -20.2300
25 C8x C 13.2300 -20.9300
26 C8y C 13.2300 -22.3300
27 C8x C 14.4200 -23.0300
28 C8y C 15.6800 -22.3300
29 X Cl 16.8700 -23.0300
30 S4a S 12.0400 -23.0300
31 N1b N 10.7800 -23.7300
32 O3c O 12.7400 -24.2900
33 O3c O 11.3400 -21.8400
34 C5a C 9.5900 -23.0300
35 C1b C 8.4000 -23.7300
36 O5a O 9.5900 -21.6300
37 C1a C 7.2100 -23.0300
BOND 39
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 2 7 1
8 7 8 3
9 6 9 1
10 4 10 1
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 11 16 1
18 12 17 1
19 16 18 1
20 13 19 1
21 19 20 1
22 20 21 1
23 20 22 2
24 21 23 1
25 23 24 2
26 24 25 1
27 25 26 2
28 26 27 1
29 27 28 2
30 23 28 1
31 28 29 1
32 26 30 1
33 30 31 1
34 30 32 2
35 30 33 2
36 31 34 1
37 34 35 1
38 34 36 2
39 35 37 1
|
|---|
