CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00002336" 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 CFAMM00002336
Family CFFAD10 5-hydroxytryptamine receptor 2C ligand Tetracyclic antidepressant Mirtazapine Family
Superfamily CFSAD10 5-hydroxytryptamine receptor 2C ligand Tetracyclic antidepressant Mirtazapine Superfamily
Class CFCAD10 Class 10
External ID CHEMBL496603 External Source CHEMBL
PubChem CID 44186429 Functional Category Bioactive
Molecule Name SureCN13445100
IUPAC Name 6-[4-[4-[(4-fluorophenyl)methyl]phthalazin-1-yl]piperazin-1-yl]pyridine-3-carbonitrile
Synonyms AGN-PC-07270C;CHEBI:601093;6-[4-[4-[(4-fluorophenyl)methyl]phthalazin-1-yl]piperazin-1-yl]pyridine-3-carbonitrile
InChi InChI=1S/C25H21FN6/c26-20-8-5-18(6-9-20)15-23-21-3-1-2-4-22(21)25(30-29-23)32-13-11-31(12-14-32)24-10-7-19(16-27)17-28-24/h1-10,17H,11-15H2
InChiKey PZHMWEYKHTVOIV-UHFFFAOYSA-N
Formula C25H21FN6 Molecular Weight 424.47
Cross Link CHEMBL496603
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
 

 

39236 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', 'CFAMM00002336'),None, txtsearch, CFAMM00002336|