| Collection |
D4 : TTD |
| Chemical Name |
Azithromycin-N-benzyltriazolyldecahydroxamic Acid ( From PubChem : A Z I T H R O M Y C I N - N - B E N Z Y L T R I A Z O L Y L D E C A H Y D R O X A M I C A C I D ) |
| 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 |
| 1077.39 g/mol |
7 |
20 |
5.6846 |
False(0/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 6 H 9 6 N 6 O 1 4 / c 1 - 1 4 - 4 4 - 5 6 ( 1 0 , 6 9 ) 4 9 ( 6 5 ) 3 8 ( 6 ) 6 0 ( 1 1 ) 3 1 - 3 4 ( 2 ) 2 9 - 5 4 ( 8 , 6 8 ) 5 1 ( 3 6 ( 4 ) 4 8 ( 3 7 ( 5 ) 5 2 ( 6 7 ) 7 4 - 4 4 ) 7 5 - 4 6 - 3 0 - 5 5 ( 9 , 7 1 - 1 3 ) 5 0 ( 6 6 ) 3 9 ( 7 ) 7 3 - 4 6 ) 7 6 - 5 3 - 4 7 ( 6 4 ) 4 3 ( 2 8 - 3 5 ( 3 ) 7 2 - 5 3 ) 6 1 ( 1 2 ) 3 2 - 4 0 - 2 3 - 2 5 - 4 1 ( 2 6 - 2 4 - 4 0 ) 4 2 - 3 3 - 6 2 ( 5 9 - 5 7 - 4 2 ) 2 7 - 2 1 - 1 9 - 1 7 - 1 5 - 1 6 - 1 8 - 2 0 - 2 2 - 4 5 ( 6 3 ) 5 8 - 7 0 / h 2 3 - 2 6 , 3 3 - 3 9 , 4 3 - 4 4 , 4 6 - 5 1 , 5 3 , 6 4 - 6 6 , 6 8 - 7 0 H , 1 4 - 2 2 , 2 7 - 3 2 H 2 , 1 - 1 3 H 3 , ( H , 5 8 , 6 3 ) / t 3 4 - , 3 5 - , 3 6 + , 3 7 - , 3 8 - , 3 9 + , 4 3 + , 4 4 - , 4 6 + , 4 7 - , 4 8 + , 4 9 - , 5 0 + , 5 1 - , 5 3 + , 5 4 - , 5 5 - , 5 6 - / m 1 / s 1 |
| InChIKey |
P V D B H H H R L S R B I I - G J U N K S M Q S A - N
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | HDAC1 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
