CFam Chemical Families Database
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You are searching for "CFAMM00147872" 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 CFAMM00147872
Family CFFCD273 Nicotinic acetylcholine receptor Ligand AZD0328 Family
Superfamily CFSCD249 Nicotinic acetylcholine receptor Ligand AZD0328 Superfamily
Class CFCCD189 Class 1002
External ID CHEMBL539329 External Source CHEMBL
PubChem CID 11340773 Functional Category Bioactive
Molecule Name SureCN6186751
IUPAC Name 7-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide;trihydrochloride
Synonyms AGN-PC-007557;7-[[1-(pyridin-4-ylmethyl)piperidin-4-yl]methoxy]-3,4-dihydro-1H-isoquinoline-2-carboximidamide;trihydrochloride
InChi InChI=1S/C22H29N5O.3ClH/c23-22(24)27-12-7-19-1-2-21(13-20(19)15-27)28-16-18-5-10-26(11-6-18)14-17-3-8-25-9-4-17;;;/h1-4,8-9,13,18H,5-7,10-12,14-16H2,(H3,23,24);3*1H
InChiKey QLPLZNLZKLMRHR-UHFFFAOYSA-N
Formula C22H32Cl3N5O Molecular Weight 488.88
Cross Link CHEMBL539329
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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