| Collection |
D4 : Boss |
| Chemical Name |
c22h30n2o5s2.hcl ( From PubChem : S P I R A P R I L H C L ) |
| FDA |
NPC |
WHO |
Indian |
Australia |
China |
Traditional
Herbal |
Clinical
Trail |
| Approved | Not | Not | Not | Not | Not | Not | Not |
|
Molecular
Weight |
Hydrogen Bond
Donor Count |
Hydrogen Bond
Acceptor Count |
cLogP |
Lipinski Rule |
| 503.075 g/mol |
3 |
9 |
3.5216 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 3 0 N 2 O 5 S 2 . C l H / c 1 - 3 - 2 9 - 2 1 ( 2 8 ) 1 7 ( 1 0 - 9 - 1 6 - 7 - 5 - 4 - 6 - 8 - 1 6 ) 2 3 - 1 5 ( 2 ) 1 9 ( 2 5 ) 2 4 - 1 4 - 2 2 ( 3 0 - 1 1 - 1 2 - 3 1 - 2 2 ) 1 3 - 1 8 ( 2 4 ) 2 0 ( 2 6 ) 2 7 ; / h 4 - 8 , 1 5 , 1 7 - 1 8 , 2 3 H , 3 , 9 - 1 4 H 2 , 1 - 2 H 3 , ( H , 2 6 , 2 7 ) ; 1 H / t 1 5 - , 1 7 - , 1 8 - ; / m 0 . / s 1 |
| InChIKey |
C L D O L N O R S L L Q D I - O O A I B O N U S A - N
|
| Links |
|
Gene
(19 /
19)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
