CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00304028" 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 CFAMM00304028
Family CFFID4197 Choline kinase alpha Inhibitor Bisquinolinium Derivative Family
Superfamily CFSID1349 Cholinesterase and Acetylcholinesterase Binder Superfamily 3
Class CFCCD12 Class 825
External ID CHEMBL185146 External Source CHEMBL
PubChem CID 44393260 Functional Category Bioactive
Molecule Name AGN-PC-075ETG
IUPAC Name
Synonyms CHEBI:407104
InChi InChI=1S/C30H28N4/c1-3-12-29-25(10-1)27-14-18-33(29)21-23-8-7-9-24(20-23)22-34-19-15-28(32-17-6-5-16-31-27)26-11-2-4-13-30(26)34/h1-4,7-15,18-20H,5-6,16-17,21-22H2/p+2/b31-27+,32-28?
InChiKey ZKJOZXWPIQEWBZ-FUQISJQKSA-P
Formula C30H30N4 Molecular Weight 446.59
Cross Link CHEMBL185146
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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