CFam Chemical Families Database
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You are searching for "CFAMM00028659" 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 CFAMM00028659
Family CFFAD161 Reverse transcriptase Inhibitor Nevirapine Family
Superfamily CFSAD150 Reverse transcriptase Inhibitor Nevirapine Superfamily
Class CFCAD148 Class 148
External ID CHEMBL512583 External Source CHEMBL
PubChem CID 17984783 Functional Category Bioactive
Molecule Name AGN-PC-01NJKQ
IUPAC Name 6-(3-chloroanilino)-N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridine-3-carboxamide
Synonyms SureCN5078904;6-(3-chloroanilino)-N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridine-3-carboxamide
InChi InChI=1S/C22H21ClFN3O/c1-14(2)19-11-21(27-18-5-3-4-16(23)10-18)25-13-20(19)22(28)26-12-15-6-8-17(24)9-7-15/h3-11,13-14H,12H2,1-2H3,(H,25,27)(H,26,28)
InChiKey HRFSPRYAKFJJPT-UHFFFAOYSA-N
Formula C22H21ClFN3O Molecular Weight 397.87
Cross Link CHEMBL512583
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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