| Collection |
D4 : TTD |
| Chemical Name |
ABT-839 ( From PubChem : A B T - 8 3 9 ) |
| 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 |
| 538.784 g/mol |
2 |
6 |
7.5615 |
False(2/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 2 H 4 6 N 2 O 3 S / c 1 - 4 - 5 - 1 9 - 3 4 ( 2 0 - 1 7 - 2 5 - 1 2 - 7 - 6 - 8 - 1 3 - 2 5 ) 2 3 - 2 6 - 1 5 - 1 6 - 2 8 ( 2 9 ( 2 2 - 2 6 ) 2 7 - 1 4 - 1 0 - 9 - 1 1 - 2 4 ( 2 7 ) 2 ) 3 1 ( 3 5 ) 3 3 - 3 0 ( 3 2 ( 3 6 ) 3 7 ) 1 8 - 2 1 - 3 8 - 3 / h 9 - 1 1 , 1 4 - 1 6 , 2 2 , 2 5 , 3 0 H , 4 - 8 , 1 2 - 1 3 , 1 7 - 2 1 , 2 3 H 2 , 1 - 3 H 3 , ( H , 3 3 , 3 5 ) ( H , 3 6 , 3 7 ) / t 3 0 - / m 0 / s 1 |
| InChIKey |
G A Q H Y Z N O M L X S E A - P M E R E L P U S A - N
|
| Links |
|
Gene
(3 /
4)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | CH17-360D5.1 | | | Discontinued target | | TTD | Inhibitor | FNTA | | | Discontinued target | | TTD | Inhibitor | FNTB | | | Research target | | TTD | Inhibitor | FNTB | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
