CFam Chemical Families Database
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You are searching for "CFAMM00114238" 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 CFAMM00114238
Family CFFAD952 Prothrombin Inhibitor Dabigatran Family
Superfamily CFSAD802 Prothrombin Inhibitor Dabigatran Superfamily
Class CFCAD716 Class 716
External ID CHEMBL1269901 External Source CHEMBL
PubChem CID 17757368 Functional Category Bioactive
Molecule Name AGN-PC-01LVXW
IUPAC Name 2-[(3-cyanobenzoyl)amino]-N,N-diethyl-3-(3-methoxypropyl)benzimidazole-5-carboxamide
Synonyms SureCN1467880;CHEBI:809138;2-[(3-cyanobenzoyl)amino]-N,N-diethyl-3-(3-methoxypropyl)benzimidazole-5-carboxamide
InChi InChI=1S/C24H27N5O3/c1-4-28(5-2)23(31)19-10-11-20-21(15-19)29(12-7-13-32-3)24(26-20)27-22(30)18-9-6-8-17(14-18)16-25/h6,8-11,14-15H,4-5,7,12-13H2,1-3H3,(H,26,27,30)
InChiKey NXWWBEGHBCKZRP-UHFFFAOYSA-N
Formula C24H27N5O3 Molecular Weight 433.50
Cross Link CHEMBL1269901
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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