Gene Set: D4 : CTD - pirarubicin
| Collection |
D4 : CTD |
| Chemical Name |
pirarubicin ( From PubChem : P I R A R U B I C I N ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Not | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 627.636 g/mol |
5 |
13 |
2.2525 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 2 H 3 7 N O 1 2 / c 1 - 1 4 - 3 1 ( 4 5 - 2 1 - 8 - 3 - 4 - 9 - 4 2 - 2 1 ) 1 7 ( 3 3 ) 1 0 - 2 2 ( 4 3 - 1 4 ) 4 4 - 1 9 - 1 2 - 3 2 ( 4 0 , 2 0 ( 3 5 ) 1 3 - 3 4 ) 1 1 - 1 6 - 2 4 ( 1 9 ) 3 0 ( 3 9 ) 2 6 - 2 5 ( 2 8 ( 1 6 ) 3 7 ) 2 7 ( 3 6 ) 1 5 - 6 - 5 - 7 - 1 8 ( 4 1 - 2 ) 2 3 ( 1 5 ) 2 9 ( 2 6 ) 3 8 / h 5 - 7 , 1 4 , 1 7 , 1 9 , 2 1 - 2 2 , 3 1 , 3 4 , 3 7 , 3 9 - 4 0 H , 3 - 4 , 8 - 1 3 , 3 3 H 2 , 1 - 2 H 3 |
| InChIKey |
K M S K Q Z K K O Z Q F F G - U H F F F A O Y S A - N
|
| Links |
|
Gene
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27)
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Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
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