CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00068556" 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 CFAMM00068556
Family CFFAD466 Peptide deformylase, mitochondrial Inhibitor Trimetrexate Family
Superfamily CFSAD405 Peptide deformylase, mitochondrial Inhibitor Trimetrexate Superfamily
Class CFCAD377 Class 377
External ID 22707405 External Source PubChem
PubChem CID 22707405 Functional Category Patent Compound
Molecule Name AGN-PC-03TMGH
IUPAC Name 4-(6,7-dimethoxyquinazolin-4-yl)-N-[[4-(trifluoromethoxy)phenyl]methyl]piperazine-1-carbothioamide
Synonyms 4-(6,7-dimethoxyquinazolin-4-yl)-N-[[4-(trifluoromethoxy)phenyl]methyl]piperazine-1-carbothioamide
InChi InChI=1S/C23H24F3N5O3S/c1-32-19-11-17-18(12-20(19)33-2)28-14-29-21(17)30-7-9-31(10-8-30)22(35)27-13-15-3-5-16(6-4-15)34-23(24,25)26/h3-6,11-12,14H,7-10,13H2,1-2H3,(H,27,35)
InChiKey ROJHJBYKHSEMKC-UHFFFAOYSA-N
Formula C23H24F3N5O3S Molecular Weight 507.53
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
 

 

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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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