| Collection |
D4 : CTD |
| Chemical Name |
KH 1060 ( From PubChem : L E X A C A L C I T O L ) |
| 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 |
| 460.689 g/mol |
3 |
4 |
5.8638 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 2 9 H 4 8 O 4 / c 1 - 6 - 2 9 ( 3 2 , 7 - 2 ) 1 6 - 9 - 1 7 - 3 3 - 2 1 ( 4 ) 2 5 - 1 3 - 1 4 - 2 6 - 2 2 ( 1 0 - 8 - 1 5 - 2 8 ( 2 5 , 2 6 ) 5 ) 1 1 - 1 2 - 2 3 - 1 8 - 2 4 ( 3 0 ) 1 9 - 2 7 ( 3 1 ) 2 0 ( 2 3 ) 3 / h 1 1 - 1 2 , 2 1 , 2 4 - 2 7 , 3 0 - 3 2 H , 3 , 6 - 1 0 , 1 3 - 1 9 H 2 , 1 - 2 , 4 - 5 H 3 / b 2 2 - 1 1 + , 2 3 - 1 2 - / t 2 1 - , 2 4 - , 2 5 - , 2 6 + , 2 7 + , 2 8 - / m 1 / s 1 |
| InChIKey |
K L Z O T D O J M R M L D X - Y B B V P D D N S A - N
|
| Links |
|
Gene
(8 /
18)
⊖ Less
|
|
| Download gene sets |
gmt, text, Detailed text
|
