| Entry |
|
|---|
| Name |
Oprozomib (USAN/INN) |
|---|
| Formula |
C25H32N4O7S
|
|---|
| Exact mass |
532.1992
|
|---|
| Mol weight |
532.6092
|
|---|
| Structure |
|
|---|
| Class |
Antineoplastic
DG03134 Proteasome inhibitor
|
|---|
| Efficacy |
Antineoplastic, Proteasome inhibitor |
|---|
| Target |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG03134 Proteasome inhibitor
D10318 Oprozomib
Target-based classification of drugs [BR:br08310]
Enzymes
Hydrolases (EC3)
Threonine peptidases
PSMB5
D10318 Oprozomib (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 37
1 C8x C 9.5200 -22.4000
2 C8y C 9.5200 -21.0000
3 S2x S 8.1900 -20.5800
4 C8y C 7.3500 -21.7000
5 N5x N 8.1900 -22.8200
6 C5a C 10.7100 -20.3000
7 N1b N 11.9000 -21.0000
8 O5a O 10.7100 -18.9000
9 C1c C 13.0900 -20.3000
10 C5a C 14.2800 -21.0000
11 N1b N 15.4700 -20.3000
12 O5a O 14.2800 -22.4000
13 C1c C 16.6600 -21.0000
14 C5a C 17.9200 -20.3000
15 N1b N 19.1100 -21.0700
16 O5a O 17.9200 -18.9000
17 C1c C 20.3000 -20.3700
18 C5a C 21.4900 -21.0700
19 O5a O 21.4900 -22.4700
20 C1a C 5.9500 -21.7000
21 C1b C 13.0900 -18.9000
22 O2a O 14.2800 -18.1300
23 C1a C 14.2800 -16.7300
24 C1b C 20.3000 -18.7600
25 C8y C 21.4900 -18.0600
26 C1b C 16.6600 -22.4000
27 O2a O 17.8500 -23.1000
28 C1a C 17.8500 -24.5000
29 C1z C 22.6800 -20.3700
30 C8x C 21.4900 -16.6600
31 C8x C 22.6800 -18.7600
32 C8x C 23.9400 -18.0600
33 C8x C 23.9400 -16.6600
34 C8x C 22.6800 -15.9600
35 C1a C 23.8700 -21.0700
36 O2x O 21.9800 -19.1800
37 C1x C 23.3800 -19.1800
BOND 39
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 1 5 1
6 2 6 1
7 6 7 1
8 6 8 2
9 7 9 1
10 9 10 1
11 10 11 1
12 10 12 2
13 11 13 1
14 13 14 1
15 14 15 1
16 14 16 2
17 15 17 1
18 17 18 1
19 18 19 2
20 4 20 1
21 9 21 1 #Up
22 21 22 1
23 22 23 1
24 17 24 1 #Up
25 24 25 1
26 13 26 1 #Down
27 26 27 1
28 27 28 1
29 29 18 1 #Down
30 30 25 2
31 31 32 2
32 32 33 1
33 33 34 2
34 30 34 1
35 31 25 1
36 29 35 1 #Up
37 36 37 1
38 37 29 1
39 29 36 1
|
|---|
