| Entry |
|
|---|
| Name |
Indibulin (USAN/INN) |
|---|
| Formula |
C22H16ClN3O2
|
|---|
| Exact mass |
389.0931
|
|---|
| Mol weight |
389.83
|
|---|
| Structure |
|
|---|
| Efficacy |
Antineoplastic, Tubulin polymerization inhibitor |
|---|
| Target |
|
|---|
| Brite |
Target-based classification of drugs [BR:br08310]
Not elsewhere classified
Cellular process
Cytoskeleton
TUBB
D10013 Indibulin (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 28
1 N4y N 16.3800 -18.9700
2 C8y C 16.8000 -20.3000
3 C8y C 18.2000 -20.3000
4 C8y C 18.6200 -18.9700
5 C8x C 17.5000 -18.1300
6 C5a C 19.8100 -18.2700
7 C5a C 21.0000 -18.9700
8 O5a O 19.8100 -16.8700
9 N1b N 22.1900 -18.2700
10 O5a O 21.0000 -20.3700
11 C8y C 23.3800 -18.9700
12 C8x C 23.3800 -20.3700
13 C8x C 24.6400 -21.0700
14 N5x N 25.8300 -20.3700
15 C8x C 25.8300 -18.9700
16 C8x C 24.6400 -18.2700
17 C1b C 15.1900 -18.2700
18 C8y C 14.0000 -18.9700
19 C8x C 12.8100 -18.2700
20 C8x C 11.5500 -18.9700
21 C8y C 11.5500 -20.3700
22 C8x C 12.7400 -21.0700
23 C8x C 14.0000 -20.3700
24 C8x C 16.1000 -21.5124
25 C8x C 16.8000 -22.7249
26 C8x C 18.2000 -22.7249
27 C8x C 18.9000 -21.5124
28 X Cl 10.3347 -21.0651
BOND 31
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 1 5 1
6 6 7 1
7 6 4 1
8 6 8 2
9 7 9 1
10 7 10 2
11 9 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 11 16 1
18 17 1 1
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
26 2 24 2
27 24 25 1
28 25 26 2
29 26 27 1
30 3 27 2
31 21 28 1
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