| Entry |
|
|---|
| Name |
Pocenbrodib (USAN/INN) |
|---|
| Formula |
C28H32FN3O6
|
|---|
| Exact mass |
525.2275
|
|---|
| Mol weight |
525.57
|
|---|
| Structure |
|
|---|
| Remark |
|
|---|
| Efficacy |
Antineoplastic, Transcriptional co-factors inhibitor |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Acyltransferases
CREBBP/EP300
D12924 Pocenbrodib (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 38
1 C8y C 16.8000 -26.8100
2 C8x C 16.8000 -25.4100
3 C8x C 17.9900 -24.7100
4 C8y C 19.2500 -25.4100
5 C8y C 19.2500 -26.8100
6 C8y C 17.9900 -27.5100
7 N4y N 20.5800 -24.9900
8 C8y C 21.3500 -26.1100
9 N5x N 20.5800 -27.2300
10 C1c C 22.7500 -26.1100
11 O1a O 23.4500 -24.9200
12 C1y C 21.0000 -23.6600
13 C1x C 20.0900 -22.6100
14 C1y C 20.5100 -21.2800
15 C1x C 21.8400 -21.0000
16 C1x C 22.8200 -22.0500
17 C1x C 22.3300 -23.3800
18 C6a C 19.6000 -20.2300
19 O6a O 18.2000 -20.5100
20 O6a O 20.0200 -18.9000
21 C8y C 23.4500 -27.3000
22 C8x C 22.7500 -28.4900
23 C8y C 23.4500 -29.7500
24 C8x C 24.8500 -29.7500
25 C8x C 25.5500 -28.5600
26 C8y C 24.8500 -27.3000
27 X F 22.7500 -30.9400
28 O2a O 25.5500 -26.1100
29 C1a C 26.9500 -26.1100
30 N1y N 15.5400 -27.5100
31 C1y C 15.5400 -28.9100
32 C1x C 16.7300 -29.6100
33 C1x C 17.9900 -28.9100
34 C7a C 14.4200 -26.8100
35 O7a O 13.2300 -27.5100
36 C1a C 12.0400 -26.8100
37 O6a O 14.4200 -25.4100
38 C1a C 14.3500 -29.6100
BOND 42
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 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 10 8 1
12 10 11 1 #Down
13 12 7 1 #Up
14 12 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 12 17 1
20 14 18 1 #Down
21 18 19 1
22 18 20 2
23 10 21 1
24 21 22 2
25 22 23 1
26 23 24 2
27 24 25 1
28 25 26 2
29 21 26 1
30 23 27 1
31 26 28 1
32 28 29 1
33 1 30 1
34 30 31 1
35 31 32 1
36 32 33 1
37 6 33 1
38 30 34 1
39 34 35 1
40 35 36 1
41 34 37 2
42 31 38 1 #Down
|
|---|
