CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00441444" 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 CFAMM00441444
Family CFFBM17255 Coagulation factor X inhibitor SureCN5644036 family
Superfamily CFSBM4308 Coagulation factor X and Prothrombin Binder Superfamily 10
Class CFCBM176 Class 3226
External ID CHEMBL518401 External Source CHEMBL
PubChem CID 44581494 Functional Category Bioactive
Molecule Name AGN-PC-077N0Q
IUPAC Name 1-(4-methoxyphenyl)-6-[4-[1-(methylamino)cyclopropyl]phenyl]-3-(trifluoromethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;2,2,2-trifluoroacetic acid
Synonyms CHEBI:595892;1-(4-methoxyphenyl)-6-[4-[1-(methylamino)cyclopropyl]phenyl]-3-(trifluoromethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one;2,2,2-trifluoroacetic acid
InChi InChI=1S/C24H23F3N4O2.C2HF3O2/c1-28-23(12-13-23)15-3-5-16(6-4-15)30-14-11-19-20(22(30)32)31(29-21(19)24(25,26)27)17-7-9-18(33-2)10-8-17;3-2(4,5)1(6)7/h3-10,28H,11-14H2,1-2H3;(H,6,7)
InChiKey NANBNCUWDKHENL-UHFFFAOYSA-N
Formula C26H24F6N4O4 Molecular Weight 570.48
Cross Link CHEMBL518401
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
 

 

27698 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', 'CFAMM00441444'),None, txtsearch, CFAMM00441444|