| Collection |
D4 : TTD |
| Chemical Name |
Azithromycin-N-benzyltriazolyloctahydroxamic 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 O C T 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 |
| 1049.34 g/mol |
7 |
20 |
4.9044 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 5 4 H 9 2 N 6 O 1 4 / c 1 - 1 4 - 4 2 - 5 4 ( 1 0 , 6 7 ) 4 7 ( 6 3 ) 3 6 ( 6 ) 5 8 ( 1 1 ) 2 9 - 3 2 ( 2 ) 2 7 - 5 2 ( 8 , 6 6 ) 4 9 ( 3 4 ( 4 ) 4 6 ( 3 5 ( 5 ) 5 0 ( 6 5 ) 7 2 - 4 2 ) 7 3 - 4 4 - 2 8 - 5 3 ( 9 , 6 9 - 1 3 ) 4 8 ( 6 4 ) 3 7 ( 7 ) 7 1 - 4 4 ) 7 4 - 5 1 - 4 5 ( 6 2 ) 4 1 ( 2 6 - 3 3 ( 3 ) 7 0 - 5 1 ) 5 9 ( 1 2 ) 3 0 - 3 8 - 2 1 - 2 3 - 3 9 ( 2 4 - 2 2 - 3 8 ) 4 0 - 3 1 - 6 0 ( 5 7 - 5 5 - 4 0 ) 2 5 - 1 9 - 1 7 - 1 5 - 1 6 - 1 8 - 2 0 - 4 3 ( 6 1 ) 5 6 - 6 8 / h 2 1 - 2 4 , 3 1 - 3 7 , 4 1 - 4 2 , 4 4 - 4 9 , 5 1 , 6 2 - 6 4 , 6 6 - 6 8 H , 1 4 - 2 0 , 2 5 - 3 0 H 2 , 1 - 1 3 H 3 , ( H , 5 6 , 6 1 ) / t 3 2 - , 3 3 - , 3 4 + , 3 5 - , 3 6 - , 3 7 + , 4 1 + , 4 2 - , 4 4 + , 4 5 - , 4 6 + , 4 7 - , 4 8 + , 4 9 - , 5 1 + , 5 2 - , 5 3 - , 5 4 - / m 1 / s 1 |
| InChIKey |
Y O T A N X L D C G W P P Q - Q A S X A Q I X 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
|
