CFam Chemical Families Database
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You are searching for "CFAMM00450948" 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 CFAMM00450948
Family CFFBM19186 Coagulation factor X inhibitor (E)-2-fluoro-3-[3-(N'-methylcarbamimidoyl)phenyl]-N-[4-(3-sulfamoylpyridin-4-yl)phenyl]but-2-enamide family
Superfamily CFSBM2144 Coagulation factor X and cAMP-specific 3',5'-cyclic phosphodiesterase 4B Binder Superfamily
Class CFCAD8 Class 8
External ID CHEMBL61951 External Source CHEMBL
PubChem CID 44304970 Functional Category Bioactive
Molecule Name (E)-2-fluoro-3-[3-(N'-methylcarbamimidoyl)phenyl]-N-[4-(3-sulfamoylpyridin-4-yl)phenyl]but-2-enamide
IUPAC Name (E)-2-fluoro-3-[3-(N'-methylcarbamimidoyl)phenyl]-N-[4-(3-sulfamoylpyridin-4-yl)phenyl]but-2-enamide
Synonyms CHEBI:199149
InChi InChI=1S/C23H22FN5O3S/c1-14(16-4-3-5-17(12-16)22(25)27-2)21(24)23(30)29-18-8-6-15(7-9-18)19-10-11-28-13-20(19)33(26,31)32/h3-13H,1-2H3,(H2,25,27)(H,29,30)(H2,26,31,32)/b21-14+
InChiKey VZYOPDGWHIAFGF-KGENOOAVSA-N
Formula C23H22FN5O3S Molecular Weight 467.52
Cross Link CHEMBL61951
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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