| Collection |
D4 : TTD |
| Chemical Name |
3-(2-carboxy-4-mercaptobutyl)benzoic acid ( From PubChem : T H I O L - B A S E D I N H I B I T O R , 7 B ) |
| 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 |
| 254.302 g/mol |
3 |
5 |
1.948 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 2 H 1 4 O 4 S / c 1 3 - 1 1 ( 1 4 ) 9 - 3 - 1 - 2 - 8 ( 6 - 9 ) 7 - 1 0 ( 4 - 5 - 1 7 ) 1 2 ( 1 5 ) 1 6 / h 1 - 3 , 6 , 1 0 , 1 7 H , 4 - 5 , 7 H 2 , ( H , 1 3 , 1 4 ) ( H , 1 5 , 1 6 ) / t 1 0 - / m 0 / s 1 |
| InChIKey |
N T M S K D F H M V Z F M A - J T Q L Q I E I S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | FOLH1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
