Gene Set: D1 - Approved - B R O M O C R I P T I N E M E S Y L A T E
| Collection |
D1 : Approved |
| Chemical Name |
B R O M O C R I P T I N E M E S Y L A T E |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 750.7 g/mol |
4 |
12 |
3.9822 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 2 H 4 0 B r N 5 O 5 . C H 4 O 3 S / c 1 - 1 6 ( 2 ) 1 2 - 2 4 - 2 9 ( 4 0 ) 3 7 - 1 1 - 7 - 1 0 - 2 5 ( 3 7 ) 3 2 ( 4 2 ) 3 8 ( 2 4 ) 3 0 ( 4 1 ) 3 1 ( 4 3 - 3 2 , 1 7 ( 3 ) 4 ) 3 5 - 2 8 ( 3 9 ) 1 8 - 1 3 - 2 0 - 1 9 - 8 - 6 - 9 - 2 2 - 2 6 ( 1 9 ) 2 1 ( 2 7 ( 3 3 ) 3 4 - 2 2 ) 1 4 - 2 3 ( 2 0 ) 3 6 ( 5 ) 1 5 - 1 8 ; 1 - 5 ( 2 , 3 ) 4 / h 6 , 8 - 9 , 1 3 , 1 6 - 1 8 , 2 3 - 2 5 , 3 4 , 4 2 H , 7 , 1 0 - 1 2 , 1 4 - 1 5 H 2 , 1 - 5 H 3 , ( H , 3 5 , 3 9 ) ; 1 H 3 , ( H , 2 , 3 , 4 ) / t 1 8 - , 2 3 ? , 2 4 + , 2 5 ? , 3 1 - , 3 2 + ; / m 1 . / s 1 |
| InChIKey |
N O J M T M I R Q R D Z M T - I U S T X G B G S A - N
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| Links |
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Gene
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16)
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12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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