| Collection |
D4 : TTD |
| Chemical Name |
Zotarolimus; Abt-578 ( From PubChem : Z O T A R O L I M U S ) |
| 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 |
| 966.21 g/mol |
2 |
17 |
5.9854 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 2 H 7 9 N 5 O 1 2 / c 1 - 3 1 - 1 6 - 1 2 - 1 1 - 1 3 - 1 7 - 3 2 ( 2 ) 4 3 ( 6 5 - 8 ) 2 8 - 3 9 - 2 1 - 1 9 - 3 7 ( 7 ) 5 2 ( 6 4 , 6 9 - 3 9 ) 4 9 ( 6 1 ) 5 0 ( 6 2 ) 5 6 - 2 3 - 1 5 - 1 4 - 1 8 - 4 1 ( 5 6 ) 5 1 ( 6 3 ) 6 8 - 4 4 ( 3 4 ( 4 ) 2 6 - 3 8 - 2 0 - 2 2 - 4 0 ( 4 5 ( 2 7 - 3 8 ) 6 6 - 9 ) 5 7 - 3 0 - 5 3 - 5 4 - 5 5 - 5 7 ) 2 9 - 4 2 ( 5 8 ) 3 3 ( 3 ) 2 5 - 3 6 ( 6 ) 4 7 ( 6 0 ) 4 8 ( 6 7 - 1 0 ) 4 6 ( 5 9 ) 3 5 ( 5 ) 2 4 - 3 1 / h 1 1 - 1 3 , 1 6 - 1 7 , 2 5 , 3 0 - 3 1 , 3 3 - 3 5 , 3 7 - 4 1 , 4 3 - 4 5 , 4 7 - 4 8 , 6 0 , 6 4 H , 1 4 - 1 5 , 1 8 - 2 4 , 2 6 - 2 9 H 2 , 1 - 1 0 H 3 / b 1 3 - 1 1 - , 1 6 - 1 2 + , 3 2 - 1 7 + , 3 6 - 2 5 - / t 3 1 - , 3 3 - , 3 4 - , 3 5 - , 3 7 - , 3 8 + , 3 9 ? , 4 0 + , 4 1 ? , 4 3 + , 4 4 ? , 4 5 - , 4 7 - , 4 8 + , 5 2 - / m 1 / s 1 |
| InChIKey |
C G T A D G C B E X Y W N E - R N O V T T D P S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | MTOR | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
