| Collection |
D3 |
| Chemical Name |
I K A R U G A M Y 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 |
| 480.639 g/mol |
3 |
6 |
4.8968 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 9 H 4 0 N 2 O 4 / c 1 - 3 - 1 8 - 1 6 ( 2 ) 1 4 - 2 2 - 2 0 ( 1 8 ) 1 0 - 1 1 - 2 1 - 1 9 - 6 - 4 - 8 - 2 6 ( 3 3 ) 3 0 - 1 3 - 5 - 7 - 2 4 - 2 8 ( 3 4 ) 2 7 ( 2 9 ( 3 5 ) 3 1 - 2 4 ) 2 5 ( 3 2 ) 1 2 - 9 - 1 7 ( 1 9 ) 1 5 - 2 3 ( 2 1 ) 2 2 / h 4 , 8 , 1 0 - 1 1 , 1 6 - 2 4 , 3 4 H , 3 , 5 - 7 , 9 , 1 2 - 1 5 H 2 , 1 - 2 H 3 , ( H , 3 0 , 3 3 ) ( H , 3 1 , 3 5 ) / b 8 - 4 - / t 1 6 - , 1 7 - , 1 8 - , 1 9 + , 2 0 + , 2 1 - , 2 2 + , 2 3 + , 2 4 + / m 1 / s 1 |
| InChIKey |
C Z B T X C K F B G Y G B V - B C K B V V F B S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Concentration(M) | Regulation | Cell Line | Gene | | 0.000002 | UP | MCF7 | MAFF |
|
| Download gene sets |
Cell Line MCF7 : gmt, text, Detailed text
|
