| Entry |
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| Name |
Varlitinib tosylate (USAN) |
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| Formula |
C22H19ClN6O2S. (C7H8O3S)2
|
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| Exact mass |
810.1367
|
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| Mol weight |
811.35
|
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| Structure |
|
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| Class |
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
|
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| Remark |
|
|---|
| Efficacy |
Antineoplastic, Receptor tyrosine kinase inhibitor |
|---|
| Target |
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| Pathway |
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| Interaction |
|
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| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG01357 Varlitinib
D09690 Varlitinib tosylate
Target-based classification of drugs [BR:br08310]
Protein kinases
Receptor tyrosine kinases (RTK)
EGFR family
EGFR
D09690 Varlitinib tosylate (USAN)
ERBB2 (HER2, CD340)
D09690 Varlitinib tosylate (USAN)
ERBB4 (HER4)
D09690 Varlitinib tosylate (USAN)
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG01357 Varlitinib
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 54
1 C8x C 33.3900 -22.9600
2 C8x C 33.3900 -24.3600
3 C8y C 34.6024 -25.0600
4 C8x C 35.8149 -24.3600
5 C8x C 35.8149 -22.9600
6 C8y C 34.6024 -22.2600
7 C1a C 34.6024 -26.4600
8 S4a S 34.6024 -20.8600
9 O1d O 34.6024 -19.4600
10 O1d O 36.0024 -20.8600
11 O1d O 33.2024 -20.8600
12 C8x C 23.2400 -18.8300
13 C8y C 23.2400 -20.2300
14 C8x C 22.0500 -20.9300
15 C8y C 20.7900 -20.2300
16 C8y C 20.7900 -18.8300
17 C8x C 22.0500 -18.1300
18 C8y C 19.6000 -20.9300
19 N5x N 18.4100 -20.2300
20 C8x C 18.4100 -18.8300
21 N5x N 19.6000 -18.1300
22 N1b N 19.6000 -22.3300
23 N1b N 24.4300 -20.9300
24 C2y C 25.6200 -20.2300
25 O2x O 25.6200 -18.8300
26 C1x C 26.9500 -18.4100
27 C1y C 27.7900 -19.5300
28 N2x N 26.9500 -20.6500
29 C1a C 29.2600 -19.5300
30 C8y C 20.8600 -23.0300
31 C8x C 20.8600 -24.4300
32 C8y C 22.0500 -25.1300
33 C8y C 23.2400 -24.4300
34 C8x C 23.2400 -23.0300
35 C8x C 22.0500 -22.3300
36 X Cl 22.0500 -26.5300
37 O2a O 24.5000 -25.1300
38 C1b C 25.6900 -24.4300
39 C8y C 26.8800 -25.1300
40 S2x S 26.8800 -26.5300
41 C8x C 28.2100 -27.0200
42 C8x C 29.0500 -25.9000
43 N5x N 28.2100 -24.7100
44 C8x C 33.3900 -22.9600
45 C8x C 33.3900 -24.3600
46 C8y C 34.6024 -25.0600
47 C8x C 35.8149 -24.3600
48 C8x C 35.8149 -22.9600
49 C8y C 34.6024 -22.2600
50 S4a S 34.6024 -20.8600
51 O1d O 34.6024 -19.4600
52 O1d O 36.0024 -20.8600
53 O1d O 33.2024 -20.8600
54 C1a C 34.6024 -26.4600
BOND 58
1 12 13 1
2 13 14 2
3 14 15 1
4 15 16 2
5 16 17 1
6 12 17 2
7 15 18 1
8 18 19 2
9 19 20 1
10 20 21 2
11 16 21 1
12 18 22 1
13 13 23 1
14 23 24 1
15 24 25 1
16 25 26 1
17 26 27 1
18 27 28 1
19 24 28 2
20 27 29 1 #Up
21 22 30 1
22 30 31 2
23 31 32 1
24 32 33 2
25 33 34 1
26 34 35 2
27 30 35 1
28 32 36 1
29 33 37 1
30 37 38 1
31 38 39 1
32 39 40 1
33 40 41 1
34 41 42 2
35 42 43 1
36 39 43 2
37 1 2 2
38 2 3 1
39 3 4 2
40 4 5 1
41 5 6 2
42 1 6 1
43 3 7 1
44 6 8 1
45 8 9 1
46 8 10 2
47 8 11 2
48 44 45 2
49 45 46 1
50 46 47 2
51 47 48 1
52 48 49 2
53 44 49 1
54 46 54 1
55 49 50 1
56 50 51 1
57 50 52 2
58 50 53 2
BRACKET 1 32.8300 -26.8800 32.8300 -19.0400
1 36.3300 -19.0400 36.3300 -26.8800
1 2
ORIGINAL 1 1 2 3 4 5 6 8 9 10 11 7
REPEAT 1 44 45 46 47 48 49 50 51 52 53 54
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