CFam Chemical Families Database
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You are searching for "CFAMM00333396" 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 CFAMM00333396
Family CFFBM2376 Sodium-dependent dopamine transporter and Sodium-dependent serotonin transporter inhibitor AGN-PC-03WEDB family
Superfamily CFSBM1316 Sodium-dependent dopamine transporter and Sodium-dependent serotonin transporter Binder Superfamily 7
Class CFCAD799 Class 799
External ID CHEMBL87739 External Source CHEMBL
PubChem CID 19085936 Functional Category Bioactive
Molecule Name AGN-PC-023JAR
IUPAC Name 1-[3-(4-cyclohexylphenyl)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl]propan-1-one
Synonyms CHEBI:238416;1-[3-(4-cyclohexylphenyl)-8-methyl-8-azabicyclo[3.2.1]octan-4-yl]propan-1-one
InChi InChI=1S/C23H33NO/c1-3-22(25)23-20(15-19-13-14-21(23)24(19)2)18-11-9-17(10-12-18)16-7-5-4-6-8-16/h9-12,16,19-21,23H,3-8,13-15H2,1-2H3
InChiKey AOGDHAKOMBZIIJ-UHFFFAOYSA-N
Formula C23H33NO Molecular Weight 339.51
Cross Link CHEMBL87739
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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