CFam Chemical Families Database
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You are searching for "CFAMM00113753" in compound.

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CFAM Mol ID CFAMM00113753
Family CFFAD940 Prothrombin Inhibitor Ximelegatran Family
Superfamily CFSAD791 Prothrombin Inhibitor Ximelegatran Superfamily
Class CFCAD705 Class 705
External ID DNC008456 External Source TTD
PubChem CID 44450365 Functional Category Investigative Drug
Molecule Name 2-(4-pentylphenyl)-N-(pyridin-3-yl)acetamide
IUPAC Name 2-(4-pentylphenyl)-N-pyridin-3-ylacetamide
Synonyms AGN-PC-076CGO;DNC008456;2-(4-pentylphenyl)-N-pyridin-3-ylacetamide;2-(4-pentylphenyl)-N-(pyridin-3-yl)acetamide
InChi InChI=1S/C18H22N2O/c1-2-3-4-6-15-8-10-16(11-9-15)13-18(21)20-17-7-5-12-19-14-17/h5,7-12,14H,2-4,6,13H2,1H3,(H,20,21)
InChiKey VYJQGHFNPZKVTQ-UHFFFAOYSA-N
Formula C18H22N2O Molecular Weight 282.38
Cross Link CHEMBL260464
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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