CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00446036" 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 CFAMM00446036
Family CFFBM18171 Adenosine receptor A3 and Adenosine receptor A1 ligand AGN-PC-078W6F family
Superfamily CFSBM4240 Platelet-activating factor receptor and Beta-lactamase Binder Superfamily
Class CFCCD443 Class 1256
External ID CHEMBL379927 External Source CHEMBL
PubChem CID 11612491 Functional Category Bioactive
Molecule Name 6-[6-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-2-[4-(trifluoromethyl)phenyl]furo[2,3-d]pyridazin-7-one
IUPAC Name 6-[6-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]pyridin-3-yl]-2-[4-(trifluoromethyl)phenyl]furo[2,3-d]pyridazin-7-one
Synonyms CHEBI:452010
InChi InChI=1S/C24H22F3N5O2/c1-30(2)19-9-10-31(14-19)21-8-7-18(13-28-21)32-23(33)22-16(12-29-32)11-20(34-22)15-3-5-17(6-4-15)24(25,26)27/h3-8,11-13,19H,9-10,14H2,1-2H3/t19-/m0/s1
InChiKey LCLZDLHNBUWRJC-IBGZPJMESA-N
Formula C24H22F3N5O2 Molecular Weight 469.46
Cross Link CHEMBL379927
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
 

 

27664 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', 'CFAMM00446036'),None, txtsearch, CFAMM00446036|