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
3-[(4-ketochromen-3-yl)methyl]-9-(tetrahydropyran-2-ylmethoxy)-1,2,4,5-tetrahydropyrido[2,1-g][1,4]diazepin-7-one
PubMed
—
Wikipedia
—
Google
SMILES:
Ring Information
Rings
Ring Systems
Atoms
Carbons
Nitrogens
Oxygens
Sulfurs
5
3
32
25
2
5
0
Subset Information
Substances
Natural
Purchasable
Annotated
BB
In Man
Last Updated
View
0
2
0
0
0
2012-03-15
Parents (
3 Total
)
Tetrahydropyran
Chromone
2,3,4,5-tetrahydro-1H-pyrido[2,1…
No Child Rings
![Image of 3-[(4-ketochromen-3-yl)methyl]-9-(tetrahydropyran-2-ylmethoxy)-1,2,4,5-tetrahydropyrido[2,1-g][1,4]diazepin-7-one](http://zinc12.docking.org/img/rings/64640.gif)
![2,3,4,5-tetrahydro-1H-pyrido[2,1-g][1,4]diazepin-7-one](http://zinc12.docking.org/img/rings/22391.gif)