CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00268305" 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.

Search Results

CFAM Mol ID CFAMM00268305
Family CFFID2445 Cholinesterase Inhibitor 9-[9-(beta-carboline-9-yl)nonyl]-beta-carboline Family
Superfamily CFSID293 5-hydroxytryptamine receptor 2A and Cholinesterase Binder Superfamily
Class CFCCD303 Class 1116
External ID CHEMBL1096994 External Source CHEMBL
PubChem CID 46223340 Functional Category Bioactive
Molecule Name AGN-PC-07NGHS
IUPAC Name 2-methyl-9-[12-(2-methylpyrido[3,4-b]indol-2-ium-9-yl)dodecyl]pyrido[3,4-b]indol-2-ium;diiodide
Synonyms CHEBI:728959;2-methyl-9-[12-(2-methylpyrido[3,4-b]indol-2-ium-9-yl)dodecyl]pyrido[3,4-b]indol-2-ium;diiodide
InChi InChI=1S/C36H44N4.2HI/c1-37-25-21-31-29-17-11-13-19-33(29)39(35(31)27-37)23-15-9-7-5-3-4-6-8-10-16-24-40-34-20-14-12-18-30(34)32-22-26-38(2)28-36(32)40;;/h11-14,17-22,25-28H,3-10,15-16,23-24H2,1-2H3;2*1H/q+2;;/p-2
InChiKey PTELGLXYQYQULE-UHFFFAOYSA-L
Formula C36H44I2N4 Molecular Weight 786.57
Cross Link CHEMBL1096994
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
 

 

43031 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00268305'),None, txtsearch, CFAMM00268305|