| Collection |
D4 : TTD |
| Chemical Name |
Gadobenate Dimeglumine ( From PubChem : M U L T I H A N C E ) |
| 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 |
| 1058.15 g/mol |
14 |
26 |
-11.0381 |
False(1/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 2 H 3 1 N 3 O 1 1 . 2 C 7 H 1 7 N O 5 . G d / c 2 6 - 1 8 ( 2 7 ) 1 0 - 2 3 ( 6 - 7 - 2 4 ( 1 1 - 1 9 ( 2 8 ) 2 9 ) 1 2 - 2 0 ( 3 0 ) 3 1 ) 8 - 9 - 2 5 ( 1 3 - 2 1 ( 3 2 ) 3 3 ) 1 7 ( 2 2 ( 3 4 ) 3 5 ) 1 5 - 3 6 - 1 4 - 1 6 - 4 - 2 - 1 - 3 - 5 - 1 6 ; 2 * 1 - 8 - 2 - 4 ( 1 0 ) 6 ( 1 2 ) 7 ( 1 3 ) 5 ( 1 1 ) 3 - 9 ; / h 1 - 5 , 1 7 H , 6 - 1 5 H 2 , ( H , 2 6 , 2 7 ) ( H , 2 8 , 2 9 ) ( H , 3 0 , 3 1 ) ( H , 3 2 , 3 3 ) ( H , 3 4 , 3 5 ) ; 2 * 4 - 1 3 H , 2 - 3 H 2 , 1 H 3 ; / q ; ; ; + 3 / p - 3 / t ; 2 * 4 - , 5 + , 6 + , 7 + ; / m . 0 0 . / s 1 |
| InChIKey |
O C D A W J Y G V O L X G Z - V P V M A E N O S A - K
|
| Links |
|
Gene
(1 /
1)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Drug(s) | ALB | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
