Entry
Name
Bemcentinib (USAN/INN)
Formula
C30H34N8
Exact mass
506.2906
Mol weight
506.64
Structure
Mol file KCF file DB search
Class
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
Efficacy
Antineoplastic, Receptor tyrosine kinase inhibitor
Target
Interaction
DDI search
Brite
Drug groups [BR:br08330 ]
Antineoplastic
DG01918 Tyrosine kinase inhibitor
DG01917 Receptor tyrosine kinase inhibitor
D11438 Bemcentinib
Target-based classification of drugs [BR:br08310 ]
Protein kinases
Receptor tyrosine kinases (RTK)
AXL family
AXL
D11438 Bemcentinib (USAN/INN)
BRITE hierarchy
Other DBs
LinkDB
All DBs
KCF data
Show ATOM 38
1 C8y C 12.0400 -11.9700
2 C8x C 12.0400 -13.3700
3 C8x C 13.2300 -14.0700
4 C8y C 14.4900 -13.3700
5 C8x C 14.4900 -11.9700
6 C8y C 13.2300 -11.2700
7 C1x C 10.3600 -10.0100
8 C1y C 11.2700 -8.8900
9 C1x C 12.6700 -8.8900
10 C1x C 13.5100 -9.9400
11 C1x C 10.7100 -11.4100
12 N1b N 15.6800 -14.0700
13 C8y C 16.9400 -13.3700
14 N5x N 18.0600 -14.2100
15 N4y N 19.1800 -13.4400
16 C8y C 18.7600 -12.0400
17 N5x N 17.3600 -12.0400
18 C8y C 20.3700 -14.1400
19 N5x N 20.3700 -15.5400
20 N5x N 21.6300 -16.2400
21 C8y C 22.8200 -15.5400
22 C8y C 22.8200 -14.1400
23 C8x C 21.6300 -13.4400
24 C1x C 23.9400 -13.2300
25 C1x C 25.2700 -13.5800
26 C1x C 25.9000 -14.8400
27 C8y C 25.2700 -16.1000
28 C8y C 23.9400 -16.3800
29 C8x C 23.5048 -17.7106
30 C8x C 24.4395 -18.7529
31 C8x C 25.7695 -18.4729
32 C8x C 26.2048 -17.1422
33 N1a N 19.5957 -10.9168
34 N1y N 10.6683 -7.6259
35 C1x C 11.3288 -6.4112
36 C1x C 10.3777 -5.4076
37 C1x C 9.1293 -6.0021
38 C1x C 9.3089 -7.3731
BOND 44
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 9 10 1
8 7 11 1
9 8 9 1
10 11 1 1
11 7 8 1
12 10 6 1
13 4 12 1
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 1
18 16 17 2
19 13 17 1
20 15 18 1
21 18 19 2
22 19 20 1
23 20 21 2
24 21 22 1
25 22 23 2
26 18 23 1
27 25 26 1
28 26 27 1
29 24 25 1
30 21 28 1
31 22 24 1
32 27 28 1
33 28 29 2
34 29 30 1
35 30 31 2
36 31 32 1
37 27 32 2
38 16 33 1
39 8 34 1 #Down
40 34 35 1
41 35 36 1
42 36 37 1
43 37 38 1
44 34 38 1