Gene Set: D4 : TTD - (S)-3-Propyl-[1,4]thiazepan-(5E)-ylideneamine
| Collection |
D4 : TTD |
| Chemical Name |
(S)-3-Propyl-[1,4]thiazepan-(5E)-ylideneamine ( From PubChem : C H E M B L 1 8 6 4 3 1 ) |
| 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 |
| 172.291 g/mol |
1 |
3 |
1.7851 |
True |
|
| Structure |
|
| InChI |
I n C h I = 1 S / C 8 H 1 6 N 2 S / c 1 - 2 - 3 - 7 - 6 - 1 1 - 5 - 4 - 8 ( 9 ) 1 0 - 7 / h 7 H , 2 - 6 H 2 , 1 H 3 , ( H 2 , 9 , 1 0 ) / t 7 - / m 0 / s 1 |
| InChIKey |
S W O Q A U B W I B Z B L Q - Z E T C Q Y M H S A - N
|
| Links |
|
Gene
(3 /
3)
⊖ Less
|
| Source | Type | Unit | Value | Gene | PMID | Assay | Other | | TTD | Inhibitor | NOS1 | | | Clinical trial target | | TTD | Inhibitor | NOS2 | | | Successful target | | TTD | Inhibitor | NOS3 | | | Clinical trial target |
|
| Download gene sets |
gmt, text, Detailed text
|
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Tan Lab , Mail Stop 8117
12801 East 17th Avenue
Division of Medical Oncology , Department of Medicine
University of Colorado School of Medicine
Aurora, CO 80045, USA
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