CFam Chemical Families Database
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You are searching for "CFAMM00255463" 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 CFAMM00255463
Family CFFID1951 Acetylcholinesterase Inhibitor Bw-28c51 Family
Superfamily CFSID1473 Acetylcholinesterase Inhibitor Bw-28c51 Superfamily
Class CFCID773 Class 2123
External ID CHEMBL1163604 External Source CHEMBL
PubChem CID 15440425 Functional Category Bioactive
Molecule Name AGN-PC-00P8YT
IUPAC Name 1-(4-methylphenyl)-3-(4-nitroanilino)-3-phenylpropan-1-one
Synonyms SureCN13315324;CHEBI:745129;AKOS003597452;1-Propanone, 1-(4-methylphenyl)-3-[(4-nitrophenyl)amino]-3-phenyl-
InChi InChI=1S/C22H20N2O3/c1-16-7-9-18(10-8-16)22(25)15-21(17-5-3-2-4-6-17)23-19-11-13-20(14-12-19)24(26)27/h2-14,21,23H,15H2,1H3
InChiKey UHIOHBCVVQJMBM-UHFFFAOYSA-N
Formula C22H20N2O3 Molecular Weight 360.41
Cross Link CHEMBL1163604
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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