CFam Chemical Families Database
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You are searching for "CFAMM00394235" 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 CFAMM00394235
Family CFFBM9288 cGMP-dependent 3',5'-cyclic phosphodiesterase and cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A inhibitor N-ethyl-1-(2-methoxyphenyl)-4-methyl-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide family
Superfamily CFSBM2267 Survival motor neuron protein and Cruzipain Binder Superfamily 2
Class CFCBM498 Class 3548
External ID CHEMBL255091 External Source CHEMBL
PubChem CID 11699504 Functional Category Bioactive
Molecule Name AGN-PC-00EDPZ
IUPAC Name 2,5-difluoro-N-[3-fluoro-4-[5-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]oxyphenyl]benzamide
Synonyms SureCN4819974;CHEBI:524280;2,5-difluoro-N-[3-fluoro-4-[5-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]pyrrolo[2,1-f][1,2,4]triazin-4-yl]oxyphenyl]benzamide
InChi InChI=1S/C27H27F3N6O3/c1-17-24(38-12-11-35-9-7-34(2)8-10-35)15-36-25(17)27(31-16-32-36)39-23-6-4-19(14-22(23)30)33-26(37)20-13-18(28)3-5-21(20)29/h3-6,13-16H,7-12H2,1-2H3,(H,33,37)
InChiKey BLAYOGMXAWDIJF-UHFFFAOYSA-N
Formula C27H27F3N6O3 Molecular Weight 540.54
Cross Link CHEMBL255091
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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