ZINC
12
User Information
Not Authenticated
—
sign in
Active cart: Temporary Cart (
0 items
)
Navigation
About
ZINC
BCIRC
Irwin Lab
Shoichet Lab
UCSF
Acknowledgements
Facts
Usage
Search
By:
Text
Structure
Properties
Catalogs
ZINC
Targets
Rings
Combination
Subsets
By:
Catalog
Property
Target
Ring
Cart
Help
Introduction
FAQ
Scripting/API
Quick Search
Problems
Filtering
History
Social
ZINC Fans
Decoy Club
DOCK Fans
Facebook
Twitter
Blog
Linkedin
Quick Search
ZINC ID or SMILES
Simple
Simple List
Systems
Systems List
Bemis-Murcko Scaffolds
B-M Scaffolds List
All
All List
Search
Identity
99%
90%
80%
70%
Substructure
N-[2-[7-(4-bicyclo[3.1.1]hept-3-enylmethyl)-5,6,8,9-tetrahydro-[1,2,4]triazolo[3,4-g][1,4]diazepin-3-yl]ethyl]benzamide
PubMed
—
Wikipedia
—
Google
SMILES:
Ring Information
Rings
Ring Systems
Atoms
Carbons
Nitrogens
Oxygens
Sulfurs
6
3
29
23
5
1
0
Subset Information
Substances
Natural
Purchasable
Annotated
BB
In Man
Last Updated
View
0
1
0
0
0
2012-03-16
Parents (
3 Total
)
Benzene
6,7,8,9-tetrahydro-5H-[1,2,4]tri…
Bicyclo[3.1.1]hept-2-ene
No Child Rings
![Image of N-[2-[7-(4-bicyclo[3.1.1]hept-3-enylmethyl)-5,6,8,9-tetrahydro-[1,2,4]triazolo[3,4-g][1,4]diazepin-3-yl]ethyl]benzamide](http://zinc12.docking.org/img/rings/79322.gif)
![6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[3,4-g][1,4]diazepine](http://zinc12.docking.org/img/rings/1805.gif)
![Bicyclo[3.1.1]hept-2-ene](http://zinc12.docking.org/img/rings/1586.gif)