CFam Chemical Families Database
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You are searching for "CFAMM00165266" in compound.

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Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00165266
Family CFFCD574 Genomic RNA for RNA-dependent RNA polymerase gene (clone HCV-J33) Inhibitor Tegobuvir Family
Superfamily CFSCD518 Genomic RNA for RNA-dependent RNA polymerase gene (clone HCV-J33) Inhibitor Tegobuvir Superfamily
Class CFCAD177 Class 177
External ID CHEMBL29631 External Source CHEMBL
PubChem CID 11443942 Functional Category Bioactive
Molecule Name 4-[4-[2-(3,4-difluorophenyl)ethyl]piperazin-1-yl]-9-nitro-5-(pyridin-3-ylmethyl)pyrimido[5,4-b]indole
IUPAC Name 4-[4-[2-(3,4-difluorophenyl)ethyl]piperazin-1-yl]-9-nitro-5-(pyridin-3-ylmethyl)pyrimido[5,4-b]indole
Synonyms AGN-PC-00987U;CHEBI:137628;4-[4-[2-(3,4-difluorophenyl)ethyl]piperazin-1-yl]-9-nitro-5-(pyridin-3-ylmethyl)pyrimido[5,4-b]indole
InChi InChI=1S/C28H25F2N7O2/c29-21-7-6-19(15-22(21)30)8-10-34-11-13-35(14-12-34)28-27-26(32-18-33-28)25-23(4-1-5-24(25)37(38)39)36(27)17-20-3-2-9-31-16-20/h1-7,9,15-16,18H,8,10-14,17H2
InChiKey UPNGEDJHCUNSGY-UHFFFAOYSA-N
Formula C28H25F2N7O2 Molecular Weight 529.54
Cross Link CHEMBL29631
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
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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