| Collection |
D4 : TTD |
| Chemical Name |
NSC-87877 ( From PubChem : N S C - 8 7 8 7 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 |
| 459.452 g/mol |
3 |
10 |
4.6092 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 1 9 H 1 3 N 3 O 7 S 2 / c 2 3 - 1 9 - 1 6 ( 1 0 - 1 7 ( 3 1 ( 2 7 , 2 8 ) 2 9 ) 1 5 - 2 - 1 - 7 - 2 0 - 1 8 ( 1 5 ) 1 9 ) 2 2 - 2 1 - 1 3 - 5 - 3 - 1 2 - 9 - 1 4 ( 3 0 ( 2 4 , 2 5 ) 2 6 ) 6 - 4 - 1 1 ( 1 2 ) 8 - 1 3 / h 1 - 1 0 , 2 1 H , ( H , 2 4 , 2 5 , 2 6 ) ( H , 2 7 , 2 8 , 2 9 ) / b 2 2 - 1 6 + |
| InChIKey |
B I Q B D H S Y Q M H H P U - C J L V F E C K S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | PTPN11 | | | Research target |
|
| Download gene sets |
gmt, text, Detailed text
|
