Gene Set: D4 : TTD - Conivaptan
| Collection |
D4 : TTD |
| Chemical Name |
Conivaptan ( From PubChem : C O N I V A P T A N ) |
| 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 |
| 498.574 g/mol |
2 |
5 |
6.6453 |
False(3/4) |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 3 2 H 2 6 N 4 O 2 / c 1 - 2 1 - 3 3 - 2 8 - 1 9 - 2 0 - 3 6 ( 2 9 - 1 4 - 8 - 7 - 1 3 - 2 7 ( 2 9 ) 3 0 ( 2 8 ) 3 4 - 2 1 ) 3 2 ( 3 8 ) 2 3 - 1 5 - 1 7 - 2 4 ( 1 8 - 1 6 - 2 3 ) 3 5 - 3 1 ( 3 7 ) 2 6 - 1 2 - 6 - 5 - 1 1 - 2 5 ( 2 6 ) 2 2 - 9 - 3 - 2 - 4 - 1 0 - 2 2 / h 2 - 1 8 H , 1 9 - 2 0 H 2 , 1 H 3 , ( H , 3 3 , 3 4 ) ( H , 3 5 , 3 7 ) |
| InChIKey |
I K E N V D N F Q M C R T R - U H F F F A O Y S A - N
|
| Links |
|
Gene
(2 /
8)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Antagonist | AVPR1A | | | Successful target | | TTD | Antagonist | AVPR1A | | | Successful target | | TTD | Multitarget | AVPR1A | | | Successful target | | TTD | Drug(s) | AVPR1A | | | Successful target | | TTD | Antagonist | AVPR2 | | | Successful target | | TTD | Antagonist | AVPR2 | | | Successful target | | TTD | Multitarget | AVPR2 | | | Successful target | | TTD | Drug(s) | AVPR2 | | | Successful target |
|
| Download gene sets |
gmt, text, Detailed text
|
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