CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00429611" 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 CFAMM00429611
Family CFFBM14664 3-oxo-5-alpha-steroid 4-dehydrogenase 1 and 3-oxo-5-alpha-steroid 4-dehydrogenase 2 inhibitor AGN-PC-073LLH family
Superfamily CFSBM4441 Prostaglandin D2 receptor and 3-oxo-5-alpha-steroid 4-dehydrogenase 1 Binder Superfamily
Class CFCID1626 Class 2976
External ID 53833634 External Source PubChem
PubChem CID 53833634 Functional Category Patent Compound
Molecule Name AGN-PC-09ZE0T
IUPAC Name ethyl 4-[3-[2-[2,2-bis(4-chlorophenyl)-1,3-benzodioxol-5-yl]acetyl]indol-1-yl]butanoate
Synonyms SureCN8480035;ethyl 4-[3-[2-[2,2-bis(4-chlorophenyl)-1,3-benzodioxol-5-yl]acetyl]indol-1-yl]butanoate
InChi InChI=1S/C35H29Cl2NO5/c1-2-41-34(40)8-5-19-38-22-29(28-6-3-4-7-30(28)38)31(39)20-23-9-18-32-33(21-23)43-35(42-32,24-10-14-26(36)15-11-24)25-12-16-27(37)17-13-25/h3-4,6-7,9-18,21-22H,2,5,8,19-20H2,1H3
InChiKey GEEHMSFNGGISSO-UHFFFAOYSA-N
Formula C35H29Cl2NO5 Molecular Weight 614.51
Cross Link
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
 

 

27515 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', 'CFAMM00429611'),None, txtsearch, CFAMM00429611|