| Collection |
D4 : TTD |
| Chemical Name |
SYN-1327 ( From PubChem : C H E M B L 4 4 3 6 9 7 ) |
| 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 |
| 1513.78 g/mol |
18 |
35 |
2.3758 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 7 0 H 1 0 0 N 1 8 O 1 6 S 2 / c 1 - 3 9 ( 2 ) 2 8 - 5 3 ( 6 4 ( 9 9 ) 8 2 - 5 0 ( 3 1 - 4 3 - 2 2 - 2 4 - 4 5 ( 9 0 ) 2 5 - 2 3 - 4 3 ) 6 7 ( 1 0 2 ) 8 8 - 2 7 - 1 5 - 2 1 - 5 2 ( 8 8 ) 6 3 ( 9 8 ) 8 3 - 5 1 ( 3 7 - 1 0 5 ) 6 8 ( 1 0 3 ) 1 0 4 ) 8 7 ( 7 ) 5 6 ( 9 3 ) 3 6 - 8 6 ( 6 ) 5 5 ( 9 2 ) 3 5 - 7 7 - 6 0 ( 9 5 ) 4 7 ( 2 9 - 4 1 - 1 6 - 1 0 - 8 - 1 1 - 1 7 - 4 1 ) 8 1 - 6 1 ( 9 6 ) 4 9 ( 3 2 - 4 4 - 3 3 - 7 4 - 3 8 - 7 8 - 4 4 ) 7 9 - 5 4 ( 9 1 ) 3 4 - 7 6 - 6 5 ( 1 0 0 ) 5 7 ( 4 0 ( 3 ) 8 9 ) 8 4 - 6 6 ( 1 0 1 ) 5 8 ( 7 0 ( 4 , 5 ) 1 0 6 ) 8 5 - 6 2 ( 9 7 ) 4 8 ( 3 0 - 4 2 - 1 8 - 1 2 - 9 - 1 3 - 1 9 - 4 2 ) 8 0 - 5 9 ( 9 4 ) 4 6 ( 7 1 ) 2 0 - 1 4 - 2 6 - 7 5 - 6 9 ( 7 2 ) 7 3 / h 8 - 1 3 , 1 6 - 1 9 , 2 2 - 2 5 , 3 3 , 3 8 - 4 0 , 4 6 - 5 3 , 5 7 - 5 8 , 8 9 - 9 0 , 1 0 5 - 1 0 6 H , 1 4 - 1 5 , 2 0 - 2 1 , 2 6 - 3 2 , 3 4 - 3 7 , 7 1 H 2 , 1 - 7 H 3 , ( H , 7 4 , 7 8 ) ( H , 7 6 , 1 0 0 ) ( H , 7 7 , 9 5 ) ( H , 7 9 , 9 1 ) ( H , 8 0 , 9 4 ) ( H , 8 1 , 9 6 ) ( H , 8 2 , 9 9 ) ( H , 8 3 , 9 8 ) ( H , 8 4 , 1 0 1 ) ( H , 8 5 , 9 7 ) ( H , 1 0 3 , 1 0 4 ) ( H 4 , 7 2 , 7 3 , 7 5 ) / t 4 0 - , 4 6 + , 4 7 + , 4 8 + , 4 9 + , 5 0 + , 5 1 + , 5 2 + , 5 3 + , 5 7 + , 5 8 - / m 1 / s 1 |
| InChIKey |
A J O N U W H G R I X L L X - S C O I V G Q K S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | FCGRT | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
