| Entry |
|
|---|
| Name |
Paxalisib (USAN/INN) |
|---|
| Formula |
C18H22N8O2
|
|---|
| Exact mass |
382.1866
|
|---|
| Mol weight |
382.4197
|
|---|
| Structure |
|
|---|
| Efficacy |
Antineoplastic, Phosphatidylinositol 3-kinase inhibitor, mTOR inhibitor |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Protein kinases
Serine/threonine kinases
Other
MTOR
D11869 Paxalisib (USAN/INN)
Enzymes
Transferases (EC2)
Phosphotransferase
PIK3CA
D11869 Paxalisib (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 28
1 N5x N 16.0300 -18.8300
2 C8y C 16.0300 -20.2300
3 N5x N 17.2200 -20.9300
4 C8x C 18.4100 -20.2300
5 C8y C 18.4100 -18.8300
6 C8x C 17.2200 -18.2000
7 C8y C 19.6700 -18.1300
8 N5x N 20.8600 -18.8300
9 C8y C 22.0500 -18.1300
10 C8y C 22.0500 -16.7300
11 C8y C 20.8600 -16.0300
12 N5x N 19.6700 -16.7300
13 N4y N 23.4500 -18.5500
14 C8y C 24.2900 -17.4300
15 N5x N 23.4500 -16.3100
16 N1y N 20.8600 -14.7000
17 C1x C 22.1200 -13.9300
18 C1x C 22.1200 -12.5300
19 O2x O 20.9300 -11.8300
20 C1x C 19.6700 -12.6000
21 C1x C 19.6700 -14.0000
22 N1a N 14.8400 -20.9300
23 C1z C 25.6900 -17.5700
24 O2x O 26.2500 -18.9000
25 C1x C 25.4100 -20.0200
26 C1x C 24.0100 -19.8100
27 C1a C 26.5300 -16.4500
28 C1a C 25.1300 -16.3100
BOND 32
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 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 9 13 1
15 13 14 1
16 14 15 2
17 10 15 1
18 11 16 1
19 16 17 1
20 17 18 1
21 18 19 1
22 19 20 1
23 20 21 1
24 16 21 1
25 2 22 1
26 14 23 1
27 23 24 1
28 24 25 1
29 25 26 1
30 13 26 1
31 23 27 1
32 23 28 1
|
|---|
