| Collection |
D4 : TTD |
| Chemical Name |
BMS-599626 ( From PubChem : B M S - 5 9 9 6 2 6 ) |
| 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 |
| 530.553 g/mol |
3 |
10 |
4.3301 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 7 H 2 7 F N 8 O 3 / c 1 - 1 7 - 2 3 ( 3 4 - 2 7 ( 3 7 ) 3 9 - 1 5 - 2 2 - 1 4 - 3 8 - 8 - 7 - 2 9 - 2 2 ) 1 3 - 3 6 - 2 5 ( 1 7 ) 2 6 ( 3 0 - 1 6 - 3 2 - 3 6 ) 3 3 - 2 1 - 5 - 6 - 2 4 - 1 9 ( 1 0 - 2 1 ) 1 1 - 3 1 - 3 5 ( 2 4 ) 1 2 - 1 8 - 3 - 2 - 4 - 2 0 ( 2 8 ) 9 - 1 8 / h 2 - 6 , 9 - 1 1 , 1 3 , 1 6 , 2 2 , 2 9 H , 7 - 8 , 1 2 , 1 4 - 1 5 H 2 , 1 H 3 , ( H , 3 4 , 3 7 ) ( H , 3 0 , 3 2 , 3 3 ) / t 2 2 - / m 0 / s 1 |
| InChIKey |
L U J Z Z Y W H B D H D Q X - Q F I P X V F Z S A - N
|
| Links |
|
Gene
(2 /
8)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
