| Collection |
D4 : TTD |
| Chemical Name |
L-738167 ( From PubChem : C H E M B L 2 9 8 6 5 5 ) |
| 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 |
| 546.639 g/mol |
4 |
12 |
2.7179 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 5 H 3 4 N 6 O 6 S / c 1 - 1 7 - 3 - 5 - 1 9 ( 6 - 4 - 1 7 ) 3 8 ( 3 6 , 3 7 ) 2 9 - 2 1 ( 2 5 ( 3 4 ) 3 5 ) 1 6 - 2 7 - 2 3 ( 3 2 ) 2 0 - 1 5 - 2 2 - 2 4 ( 3 3 ) 3 0 ( 1 2 - 2 - 1 3 - 3 1 ( 2 2 ) 2 8 - 2 0 ) 1 4 - 9 - 1 8 - 7 - 1 0 - 2 6 - 1 1 - 8 - 1 8 / h 3 - 6 , 1 5 , 1 8 , 2 1 , 2 6 , 2 9 H , 2 , 7 - 1 4 , 1 6 H 2 , 1 H 3 , ( H , 2 7 , 3 2 ) ( H , 3 4 , 3 5 ) / t 2 1 - / m 0 / s 1 |
| InChIKey |
Y L F F Z E Q H D M F O E C - N R F A N R H F S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | ITGB3 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
