| Entry |
|
|---|
| Name |
Brincidofovir (USAN);
Tembexa (TN) |
|---|
| Product |
|
|---|
| Formula |
C27H52N3O7P
|
|---|
| Exact mass |
561.3543
|
|---|
| Mol weight |
561.6914
|
|---|
| Structure |
|
|---|
| Class |
Metabolizing enzyme substrate
DG02980 CYP4F2 substrate
|
|---|
| Remark |
|
|---|
| Efficacy |
Antiviral, DNA polymeraase inhibitor |
|---|
| Disease |
Human smallpox disease [DS: H00372] |
|---|
| Comment |
Active form of prodrug: Cidofovir [DR: D00273]
|
|---|
| Target |
Orthopoxvirus DNA polymerase [KO: K25268] |
|---|
| Pathway |
|
|---|
| Metabolism |
Enzyme: CYP4F2 [HSA: 8529]
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
J ANTIINFECTIVES FOR SYSTEMIC USE
J05 ANTIVIRALS FOR SYSTEMIC USE
J05A DIRECT ACTING ANTIVIRALS
J05AB Nucleosides and nucleotides excl. reverse transcriptase inhibitors
J05AB17 Brincidofovir
D10547 Brincidofovir (USAN) <US>
Drug groups [BR:br08330]
Metabolizing enzyme substrate
DG02980 CYP4F2 substrate
D10547 Brincidofovir
Antimicrobials [BR:br08307]
Antivirals
Genome replication inhibitor
Other inhibitor
D10547 Brincidofovir (USAN) <US>
Drug metabolizing enzymes and transporters [br08309.html]
Drug metabolizing enzymes
D10547
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 38
1 N4y N 32.2000 -16.5200
2 C1b C 32.2000 -17.8500
3 C8y C 33.3900 -15.8200
4 C8x C 31.0100 -15.8200
5 C1c C 31.0100 -18.5500
6 N5x N 33.3900 -14.4200
7 O5x O 34.5800 -16.5200
8 C8x C 31.0100 -14.4900
9 O2a O 29.7500 -17.8500
10 C1b C 31.0100 -19.8800
11 C8y C 32.2000 -13.7200
12 C1b C 28.7000 -18.5500
13 N1a N 32.2000 -12.4600
14 P1b P 27.4400 -17.7800
15 O1a O 32.2000 -20.5800
16 O2b O 26.2105 -18.4495
17 C1b C 25.0079 -17.7143
18 O1c O 26.7400 -16.5676
19 O1c O 28.4299 -16.7901
20 C1b C 23.7664 -18.3902
21 C1b C 22.6051 -17.6804
22 O2a O 21.3670 -18.3542
23 C1b C 20.1539 -17.6124
24 C1b C 18.9175 -18.2852
25 C1b C 17.7036 -17.5429
26 C1b C 16.4676 -18.2153
27 C1b C 15.2536 -17.4729
28 C1b C 14.0176 -18.1453
29 C1b C 12.8037 -17.4028
30 C1b C 11.5675 -18.0752
31 C1b C 10.3538 -17.3327
32 C1b C 9.1174 -18.0050
33 C1b C 7.9038 -17.2625
34 C1b C 6.6674 -17.9349
35 C1b C 5.4539 -17.1924
36 C1b C 4.2173 -17.8647
37 C1b C 3.0040 -17.1222
38 C1a C 1.7672 -17.7945
BOND 38
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 2
7 4 8 2
8 5 9 1 #Up
9 5 10 1
10 6 11 2
11 9 12 1
12 11 13 1
13 12 14 1
14 8 11 1
15 10 15 1
16 14 16 1
17 16 17 1
18 14 18 1
19 14 19 2
20 17 20 1
21 20 21 1
22 21 22 1
23 22 23 1
24 23 24 1
25 24 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 28 29 1
30 29 30 1
31 30 31 1
32 31 32 1
33 32 33 1
34 33 34 1
35 34 35 1
36 35 36 1
37 36 37 1
38 37 38 1
|
|---|
