| Entry |
|
|---|
| Name |
Olmutinib (USAN/INN) |
|---|
| Formula |
C26H26N6O2S
|
|---|
| Exact mass |
486.1838
|
|---|
| Mol weight |
486.5886
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG03162 EGFR inhibitor
|
|---|
| Remark |
|
|---|
| Efficacy |
Antineoplastic, Receptor tyrosine kinase inhibitor |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01E PROTEIN KINASE INHIBITORS
L01EB Epidermal growth factor receptor (EGFR) tyrosine kinase inhibitors
L01EB06 Olmutinib
D10859 Olmutinib (USAN/INN)
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG03162 EGFR inhibitor
DG02916 Olmutinib
D10859 Olmutinib
Target-based classification of drugs [BR:br08310]
Protein kinases
Receptor tyrosine kinases (RTK)
EGFR family
EGFR
D10859 Olmutinib (USAN/INN)
Drug groups [BR:br08330]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
DG03162 EGFR inhibitor
DG02916 Olmutinib
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 35
1 C8x C 19.4600 -13.5800
2 C8y C 19.4600 -14.9800
3 C8x C 18.2700 -15.6800
4 C8x C 17.0100 -14.9800
5 C8y C 17.0100 -13.5800
6 C8x C 18.2700 -12.8800
7 N1y N 20.6500 -15.6800
8 C1x C 21.8400 -14.9800
9 C1x C 23.1000 -15.6800
10 N1y N 23.1000 -17.0800
11 C1x C 21.9100 -17.7800
12 C1x C 20.6500 -17.0800
13 C1a C 24.2900 -17.7800
14 N1b N 15.8200 -12.8800
15 C8y C 14.6300 -13.5800
16 N5x N 14.6300 -14.9800
17 C8y C 13.3700 -15.6800
18 C8y C 12.1800 -14.9800
19 C8y C 12.1800 -13.5800
20 N5x N 13.3700 -12.8800
21 S2x S 10.8500 -15.4000
22 C8x C 10.0100 -14.2800
23 C8x C 10.8500 -13.1600
24 O2a O 13.3700 -17.0800
25 C8y C 12.1800 -17.7800
26 C8x C 12.1800 -19.1800
27 C8x C 10.9200 -19.8800
28 C8x C 9.7300 -19.1800
29 C8y C 9.7300 -17.7800
30 C8x C 10.9200 -17.0800
31 N1b N 8.5400 -17.0800
32 C5a C 7.3500 -17.7800
33 C2b C 6.1600 -17.0800
34 C2a C 4.9700 -17.7800
35 O5a O 7.3500 -19.1800
BOND 39
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 2 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 7 12 1
14 10 13 1
15 5 14 1
16 14 15 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 18 21 1
24 21 22 1
25 22 23 2
26 19 23 1
27 17 24 1
28 24 25 1
29 25 26 2
30 26 27 1
31 27 28 2
32 28 29 1
33 29 30 2
34 25 30 1
35 29 31 1
36 31 32 1
37 32 33 1
38 33 34 2
39 32 35 2
|
|---|
