| Collection |
D4 : TTD |
| Chemical Name |
LY2603618 ( From PubChem : L Y 2 6 0 3 6 1 8 ) |
| 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 |
| 436.303 g/mol |
3 |
8 |
3.3419 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 8 H 2 2 B r N 5 O 3 / c 1 - 1 1 - 5 - 1 6 ( 2 7 - 1 0 - 1 3 - 8 - 2 0 - 3 - 4 - 2 6 - 1 3 ) 1 5 ( 6 - 1 4 ( 1 1 ) 1 9 ) 2 3 - 1 8 ( 2 5 ) 2 4 - 1 7 - 9 - 2 1 - 1 2 ( 2 ) 7 - 2 2 - 1 7 / h 5 - 7 , 9 , 1 3 , 2 0 H , 3 - 4 , 8 , 1 0 H 2 , 1 - 2 H 3 , ( H 2 , 2 2 , 2 3 , 2 4 , 2 5 ) / t 1 3 - / m 0 / s 1 |
| InChIKey |
S Y Y B D N P G D K K J D U - Z D U S S C G K S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | CHEK1 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
