CFam Chemical Families Database
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You are searching for "CFAMM00186951" in compound.

Total 1 results found.

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 CFAMM00186951
Family CFFID308 Nicotinic acetylcholine receptor Ligand Epibatidine Family
Superfamily CFSAD88 Histamine H1 receptor ligand tricyclic antidepressant Superfamily
Class CFCAD88 Class 88
External ID CHEMBL417586 External Source CHEMBL
PubChem CID 11744115 Functional Category Bioactive
Molecule Name AGN-PC-00F9WE
IUPAC Name 3-(6-chloropyridin-3-yl)-7-[2-[3-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]heptan-7-yl]ethyl]-7-azabicyclo[2.2.1]heptane
Synonyms CHEBI:183466;3-(6-chloropyridin-3-yl)-7-[2-[3-(6-chloropyridin-3-yl)-7-azabicyclo[2.2.1]heptan-7-yl]ethyl]-7-azabicyclo[2.2.1]heptane
InChi InChI=1S/C24H28Cl2N4/c25-23-7-1-15(13-27-23)19-11-17-3-5-21(19)29(17)9-10-30-18-4-6-22(30)20(12-18)16-2-8-24(26)28-14-16/h1-2,7-8,13-14,17-22H,3-6,9-12H2
InChiKey GNZNWWVDCDZZJR-UHFFFAOYSA-N
Formula C24H28Cl2N4 Molecular Weight 443.41
Cross Link CHEMBL417586
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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