| Entry |
|
|---|
| Name |
Zurletrectinib (USAN) |
|---|
| Formula |
C19H19F2N7O2
|
|---|
| Exact mass |
415.1568
|
|---|
| Mol weight |
415.40
|
|---|
| Structure |
|
|---|
| Efficacy |
Antineoplastic, Tropomyosin receptor kinase inhibitor |
|---|
| Comment |
Treatment of solid tumors
|
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Protein kinases
Receptor tyrosine kinases (RTK)
TRK family
NTRK
D12432 Zurletrectinib (USAN)
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C8y C 17.8022 -14.0872
2 N5x N 18.9170 -14.8536
3 C8y C 20.1711 -14.2266
4 N4y N 20.2407 -12.7634
5 C8x C 19.0563 -11.9970
6 C8x C 17.8022 -12.6937
7 C8y C 21.4948 -14.7143
8 C8x C 22.3310 -13.5996
9 N5x N 21.5645 -12.4150
10 N1y N 16.5481 -14.7143
11 C1x C 15.6423 -13.5996
12 C1y C 14.3881 -14.0872
13 C1x C 14.4578 -15.4807
14 C1y C 15.7816 -15.8291
15 C8y C 14.4578 -19.2431
16 C8x C 15.5726 -20.0095
17 N5x N 16.8267 -19.3824
18 C8y C 16.8964 -17.9890
19 C8y C 15.7818 -17.2226
20 C8x C 14.4578 -17.9193
21 X F 13.2037 -19.8701
22 O2x O 18.1505 -17.3618
23 C1y C 19.2653 -18.1283
24 C1a C 19.2653 -19.4521
25 X F 13.2037 -13.3208
26 N1x N 21.4948 -16.1119
27 C5x C 22.6917 -17.0128
28 C1x C 20.5165 -17.4696
29 N1x N 21.6733 -18.1992
30 O5x O 24.1099 -17.0680
BOND 34
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 2
6 1 6 1
7 3 7 2
8 7 8 1
9 8 9 2
10 4 9 1
11 1 10 1
12 10 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 15 16 2
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 15 20 1
23 19 14 1
24 15 21 1
25 18 22 1
26 22 23 1
27 23 24 1 #Down
28 12 25 1 #Down
29 7 26 1
30 26 27 1
31 23 28 1
32 28 29 1
33 27 29 1
34 27 30 2
|
|---|
