CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00396205" 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 CFAMM00396205
Family CFFBM9530 Prothrombin and Coagulation factor X inhibitor SureCN6929748 family
Superfamily CFSBM4877 Prothrombin and Adenosine receptor A2a Binder Superfamily
Class CFCCD257 Class 1070
External ID CHEMBL428944 External Source CHEMBL
PubChem CID 44447646 Functional Category Bioactive
Molecule Name SureCN4823112
IUPAC Name N-[[4-[5-[[(3S)-3-aminopyrrolidin-1-yl]methyl]pyrrolo[2,1-f][1,2,4]triazin-4-yl]oxy-3-fluorophenyl]carbamoyl]-2-(4-fluorophenyl)acetamide
Synonyms CHEBI:524314
InChi InChI=1S/C26H25F2N7O3/c27-18-3-1-16(2-4-18)11-23(36)33-26(37)32-20-5-6-22(21(28)12-20)38-25-24-17(7-10-35(24)31-15-30-25)13-34-9-8-19(29)14-34/h1-7,10,12,15,19H,8-9,11,13-14,29H2,(H2,32,33,36,37)/t19-/m0/s1
InChiKey PVXNNCDQTCGDOV-IBGZPJMESA-N
Formula C26H25F2N7O3 Molecular Weight 521.52
Cross Link CHEMBL428944
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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