| Collection |
D4 : TTD |
| Chemical Name |
MLN2480 ( From PubChem : U N I I - Z N 9 0 E 4 0 2 7 M ) |
| 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 |
| 506.289 g/mol |
3 |
10 |
5.0243 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 7 H 1 2 C l 2 F 3 N 7 O 2 S / c 1 - 6 ( 2 8 - 1 5 ( 3 1 ) 1 2 - 1 1 ( 1 9 ) 1 3 ( 2 3 ) 2 7 - 5 - 2 6 - 1 2 ) 1 6 - 2 5 - 4 - 9 ( 3 2 - 1 6 ) 1 4 ( 3 0 ) 2 9 - 1 0 - 2 - 7 ( 1 7 ( 2 0 , 2 1 ) 2 2 ) 8 ( 1 8 ) 3 - 2 4 - 1 0 / h 2 - 6 H , 1 H 3 , ( H , 2 8 , 3 1 ) ( H 2 , 2 3 , 2 6 , 2 7 ) ( H , 2 4 , 2 9 , 3 0 ) / t 6 - / m 1 / s 1 |
| InChIKey |
V W M J H A F Y P M O M G F - Z C F I W I B F S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | RAF1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
