| Entry |
|
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| Name |
Melphalan flufenamide (USAN/INN) |
|---|
| Formula |
C24H30Cl2FN3O3
|
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| Exact mass |
497.1648
|
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| Mol weight |
498.41
|
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| Structure |
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| Remark |
|
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| Efficacy |
Antineoplastic, Alkylating agent |
|---|
| Comment |
Active form of prodrug: Melphalan [DR: D00369]
Treatment of multiple myeloma
|
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| Target |
DNA |
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| Interaction |
|
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| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
L ANTINEOPLASTIC AND IMMUNOMODULATING AGENTS
L01 ANTINEOPLASTIC AGENTS
L01A ALKYLATING AGENTS
L01AA Nitrogen mustard analogues
L01AA10 Melphalan flufenamide
D11865 Melphalan flufenamide (USAN/INN)
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 33
1 C8y C 20.4400 -15.8200
2 N1c N 21.6300 -16.5200
3 C8x C 19.1800 -16.5200
4 C8x C 20.4400 -14.4200
5 C1b C 21.6300 -17.9200
6 C1b C 22.8200 -15.8200
7 C8x C 17.9900 -15.8200
8 C8x C 19.1800 -13.7200
9 C8y C 17.9900 -14.4200
10 C1b C 16.8000 -13.7200
11 C1c C 15.5400 -14.4200
12 C5a C 14.3500 -13.7200
13 N1a N 15.5400 -15.8200
14 N1b N 13.1600 -14.4200
15 O5a O 14.3500 -12.3900
16 C1b C 22.8200 -14.4200
17 X Cl 24.0800 -13.7200
18 C1b C 20.3700 -18.6200
19 X Cl 20.3700 -20.0200
20 C1c C 11.9700 -13.7200
21 C1b C 10.7800 -14.4200
22 C7a C 11.9700 -12.3200
23 O6a O 13.2300 -11.6900
24 O7a O 10.7800 -11.5500
25 C8y C 9.5200 -13.7200
26 C1b C 10.7800 -10.1500
27 C1a C 9.5900 -9.4500
28 C8x C 9.5200 -12.3200
29 C8x C 8.3300 -11.6200
30 C8y C 7.1400 -12.3200
31 C8x C 7.1400 -13.7900
32 C8x C 8.3300 -14.4200
33 X F 5.8800 -11.6200
BOND 34
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 2
8 7 9 2
9 9 10 1
10 10 11 1
11 11 12 1
12 11 13 1 #Down
13 12 14 1
14 12 15 2
15 8 9 1
16 6 16 1
17 16 17 1
18 5 18 1
19 18 19 1
20 14 20 1
21 20 21 1
22 20 22 1 #Up
23 22 23 2
24 22 24 1
25 21 25 1
26 24 26 1
27 26 27 1
28 25 28 2
29 28 29 1
30 29 30 2
31 30 31 1
32 31 32 2
33 25 32 1
34 30 33 1
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