Entry |
|
Name |
Dilmapimod (USAN/INN) |
Formula |
C23H19F3N4O3
|
Exact mass |
456.1409
|
Mol weight |
456.4172
|
Structure |
|
Remark |
|
Efficacy |
Anti-inflammatory, Mitogen-activated protein kinase inhibitor |
Comment |
COPD, rheumatoid arthritis, atherosclerosis, neuropathic pain, acute lung injury (ALI), acute respiratory distress syndrome (ARDS)
|
Target |
|
Pathway |
|
Brite |
Target-based classification of drugs [BR:br08310]
Protein kinases
Serine/threonine kinases
CMGC group
P38
D09602 Dilmapimod (USAN/INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 33
1 N4y N 15.5400 -27.2300
2 C8y C 15.5400 -28.6300
3 C8x C 16.7524 -29.3300
4 C8x C 17.9649 -28.6300
5 C8y C 17.9649 -27.2300
6 C8y C 16.7524 -26.5300
7 C8y C 19.1773 -26.5300
8 N5x N 19.1773 -25.1300
9 C8y C 17.9649 -24.4300
10 N5x N 16.7524 -25.1300
11 C8y C 14.3276 -26.5300
12 O5x O 14.3276 -29.3300
13 C8y C 20.3918 -27.2312
14 N1b N 17.9649 -23.0302
15 C1c C 19.1961 -22.3192
16 C1b C 20.4011 -23.0148
17 C1b C 19.1958 -20.9301
18 O1a O 20.3963 -20.2367
19 O1a O 21.5835 -22.3319
20 C8y C 20.3917 -28.6298
21 C8x C 21.6042 -29.3299
22 C8y C 22.8166 -28.6299
23 C8x C 22.8166 -27.2312
24 C8x C 21.6042 -26.5312
25 C1a C 19.1630 -29.3394
26 X F 24.0316 -29.3314
27 C8y C 14.3276 -25.1302
28 C8x C 13.1151 -24.4302
29 C8x C 11.9027 -25.1302
30 C8x C 11.9027 -26.5300
31 C8y C 13.1151 -27.2300
32 X F 13.1151 -28.6298
33 X F 15.5568 -24.4203
BOND 36
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 2
8 7 8 1
9 8 9 2
10 9 10 1
11 6 10 2
12 1 11 1
13 2 12 2
14 7 13 1
15 9 14 1
16 14 15 1
17 15 16 1
18 15 17 1
19 17 18 1
20 16 19 1
21 13 20 2
22 20 21 1
23 21 22 2
24 22 23 1
25 23 24 2
26 13 24 1
27 20 25 1
28 22 26 1
29 11 27 1
30 27 28 2
31 28 29 1
32 29 30 2
33 30 31 1
34 11 31 2
35 31 32 1
36 27 33 1
|