CFam Chemical Families Database
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You are searching for "CFAMM00095982" in compound.

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CFAM Mol ID CFAMM00095982
Family CFFAD695 DNA Binder Procarbazine Family
Superfamily CFSAD588 DNA Binder Procarbazine Superfamily
Class CFCAD107 Class 107
External ID CHEMBL539185 External Source CHEMBL
PubChem CID 1336785 Functional Category Bioactive
Molecule Name ST4057834
IUPAC Name (4-methylpiperidin-1-yl)-[4-(2-phenylethynyl)phenyl]methanone
Synonyms (4-methylpiperidin-1-yl)[4-(phenylethynyl)phenyl]methanone;ZINC01170892;AC1LPRK1;Oprea1_087090;CHEBI:661404;MolPort-002-200-471;STK234959;AKOS001627315;MCULE-6999734998
InChi InChI=1S/C21H21NO/c1-17-13-15-22(16-14-17)21(23)20-11-9-19(10-12-20)8-7-18-5-3-2-4-6-18/h2-6,9-12,17H,13-16H2,1H3
InChiKey ZOOFBTWTCRPFRH-UHFFFAOYSA-N
Formula C21H21NO Molecular Weight 303.40
Cross Link CHEMBL539185
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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