CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00153571" 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 CFAMM00153571
Family CFFCD370 cAMP-specific 3',5'-cyclic phosphodiesterase 4D Inhibitor Arofylline Family
Superfamily CFSCD338 cAMP-specific 3',5'-cyclic phosphodiesterase 4D Inhibitor Arofylline Superfamily
Class CFCCD247 Class 1060
External ID 95028 External Source PubChem
PubChem CID 95028 Functional Category Patent Compound
Molecule Name 7-Benzyltheophylline
IUPAC Name 7-benzyl-1,3-dimethylpurine-2,6-dione
Synonyms Theophylline, 7-benzyl-;7-Benzyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione;N-Benzyl xanthine;NSC 14130;1807-85-8;BRN 0305370;7-Benzyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione;SMR000116995;NSC14130;AC1Q3ZES
InChi InChI=1S/C14H14N4O2/c1-16-12-11(13(19)17(2)14(16)20)18(9-15-12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChiKey WXWQVDBZDNPNLZ-UHFFFAOYSA-N
Formula C14H14N4O2 Molecular Weight 270.29
Cross Link CHEMBL24759
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
 

 

27404 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', 'CFAMM00153571'),None, txtsearch, CFAMM00153571|