CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00414458" 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 CFAMM00414458
Family CFFBM12218 Coagulation factor X and Prothrombin inhibitor SureCN5819494 family
Superfamily CFSBM5704 Coagulation factor X and Prothrombin Binder Superfamily 12
Class CFCCD463 Class 1276
External ID CHEMBL376227 External Source CHEMBL
PubChem CID 23646179 Functional Category Bioactive
Molecule Name AGN-PC-046QCX
IUPAC Name 6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-1-(4-ethylphenyl)-3-(trifluoromethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
Synonyms dihydropyrazolopyridinone analogue 6j;6-[4-[2-[(dimethylamino)methyl]phenyl]phenyl]-1-(4-ethylphenyl)-3-(trifluoromethyl)-4,5-dihydropyrazolo[3,4-c]pyridin-7-one
InChi InChI=1S/C30H29F3N4O/c1-4-20-9-13-24(14-10-20)37-27-26(28(34-37)30(31,32)33)17-18-36(29(27)38)23-15-11-21(12-16-23)25-8-6-5-7-22(25)19-35(2)3/h5-16H,4,17-19H2,1-3H3
InChiKey JMGINPKJPSJGBU-UHFFFAOYSA-N
Formula C30H29F3N4O Molecular Weight 518.57
Cross Link CHEMBL376227
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
 

 

27071 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', 'CFAMM00414458'),None, txtsearch, CFAMM00414458|