| Entry |
|
|---|
| Name |
Vamifeport (USAN/INN) |
|---|
| Formula |
C21H21FN6O2
|
|---|
| Exact mass |
408.1710
|
|---|
| Mol weight |
408.43
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Efficacy |
Ferroportin inhibitor |
|---|
| Comment |
Treatment of diseases related to dysregulation in iron metabolism
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Transporters
Solute carrier family
SLC40
SLC40A1 (FPN1, IREG1)
D12289 Vamifeport (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C8y C 6.0200 -12.9500
2 C1b C 7.2100 -13.6500
3 C1b C 8.4000 -12.9500
4 N1b N 9.5900 -13.6500
5 C1b C 10.7800 -12.9500
6 C1b C 11.9700 -13.6500
7 C8y C 13.1600 -12.9500
8 N5x N 14.3500 -13.7200
9 C8y C 15.4000 -12.8800
10 C8x C 14.9100 -11.6200
11 O2x O 13.5800 -11.6200
12 C5a C 16.5900 -13.5800
13 N1b N 17.7800 -12.8800
14 O5a O 16.5900 -14.9800
15 C1b C 18.9700 -13.5800
16 C8y C 20.1600 -12.8800
17 N5x N 21.3781 -13.5701
18 C8x C 22.5148 -12.8603
19 C8x C 22.5734 -11.4603
20 C8x C 21.3553 -10.7702
21 C8y C 20.1486 -11.4800
22 X F 18.9392 -10.7948
23 N5x N 5.8850 -11.5565
24 C8y C 4.5180 -11.2543
25 C8y C 3.8081 -12.4610
26 N4x N 4.7364 -13.5090
27 C8x C 3.8278 -10.0362
28 C8x C 2.4279 -10.0249
29 C8x C 1.7181 -11.2316
30 C8x C 2.4082 -12.4497
BOND 33
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 2
8 8 9 1
9 9 10 2
10 10 11 1
11 7 11 1
12 9 12 1
13 12 13 1
14 12 14 2
15 13 15 1
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 19 20 1
21 20 21 2
22 16 21 1
23 21 22 1
24 1 23 2
25 23 24 1
26 24 25 1
27 25 26 1
28 1 26 1
29 24 27 2
30 27 28 1
31 28 29 2
32 29 30 1
33 25 30 2
|
|---|
