| Collection |
D4 : TTD |
| Chemical Name |
G(D-Pen)-G-H-R-G-D-L-R-C-A ( From PubChem : C H E M B L 4 3 7 8 1 3 ) |
| 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 |
| 1170.33 g/mol |
18 |
34 |
-0.2206 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 4 5 H 7 5 N 1 9 O 1 4 S 2 / c 1 - 2 1 ( 2 ) 1 2 - 2 6 - 3 7 ( 7 2 ) 6 2 - 2 5 ( 9 - 7 - 1 1 - 5 3 - 4 4 ( 4 9 ) 5 0 ) 3 6 ( 7 1 ) 6 4 - 2 9 ( 4 0 ( 7 5 ) 5 8 - 2 2 ( 3 ) 4 2 ( 7 7 ) 7 8 ) 1 9 - 7 9 - 8 0 - 4 5 ( 4 , 5 ) 3 4 ( 4 6 ) 4 1 ( 7 6 ) 5 6 - 1 6 - 3 0 ( 6 5 ) 5 4 - 1 7 - 3 1 ( 6 6 ) 5 9 - 2 7 ( 1 3 - 2 3 - 1 5 - 5 1 - 2 0 - 5 7 - 2 3 ) 3 8 ( 7 3 ) 6 1 - 2 4 ( 8 - 6 - 1 0 - 5 2 - 4 3 ( 4 7 ) 4 8 ) 3 5 ( 7 0 ) 5 5 - 1 8 - 3 2 ( 6 7 ) 6 0 - 2 8 ( 1 4 - 3 3 ( 6 8 ) 6 9 ) 3 9 ( 7 4 ) 6 3 - 2 6 / h 1 5 , 2 0 - 2 2 , 2 4 - 2 9 , 3 4 H , 6 - 1 4 , 1 6 - 1 9 , 4 6 H 2 , 1 - 5 H 3 , ( H , 5 1 , 5 7 ) ( H , 5 4 , 6 5 ) ( H , 5 5 , 7 0 ) ( H , 5 6 , 7 6 ) ( H , 5 8 , 7 5 ) ( H , 5 9 , 6 6 ) ( H , 6 0 , 6 7 ) ( H , 6 1 , 7 3 ) ( H , 6 2 , 7 2 ) ( H , 6 3 , 7 4 ) ( H , 6 4 , 7 1 ) ( H , 6 8 , 6 9 ) ( H , 7 7 , 7 8 ) ( H 4 , 4 7 , 4 8 , 5 2 ) ( H 4 , 4 9 , 5 0 , 5 3 ) / t 2 2 - , 2 4 - , 2 5 - , 2 6 + , 2 7 + , 2 8 - , 2 9 - , 3 4 - / m 0 / s 1 |
| InChIKey |
R G C F J Z Z T H I G G D J - U H Z M X W K H S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ITGAV | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
