CFam Chemical Families Database
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You are searching for "CFAMM00413176" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00413176
Family CFFBM11990 Neuronal acetylcholine receptor subunit alpha-4 and Neuronal acetylcholine receptor subunit beta-2 ligand SureCN653978 family
Superfamily CFSBM889 Neuronal acetylcholine receptor subunit beta-2 and Neuronal acetylcholine receptor subunit alpha-4 Binder Superfamily 2
Class CFCID318 Class 1668
External ID CHEMBL220295 External Source CHEMBL
PubChem CID 16099111 Functional Category Bioactive
Molecule Name 2-bromo-5-[(1S,6R)-4,7-diazabicyclo[4.2.0]octan-7-yl]pyridine-3-carbonitrile
IUPAC Name 2-bromo-5-[(1S,6R)-4,7-diazabicyclo[4.2.0]octan-7-yl]pyridine-3-carbonitrile
Synonyms CHEBI:465150
InChi InChI=1S/C12H13BrN4/c13-12-9(4-14)3-10(5-16-12)17-7-8-1-2-15-6-11(8)17/h3,5,8,11,15H,1-2,6-7H2/t8-,11-/m0/s1
InChiKey LLPVKQBBRMQRGH-KWQFWETISA-N
Formula C12H13BrN4 Molecular Weight 293.16
Cross Link CHEMBL220295
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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