CFam Chemical Families Database
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You are searching for "CFAMM00071722" in compound.

Total 1 results found.

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 CFAMM00071722
Family CFFAD515 HIV-1 protease Inhibitor Lopinavir Family
Superfamily CFSAD447 HIV-1 protease Inhibitor Lopinavir Superfamily
Class CFCAD412 Class 412
External ID CHEMBL305591 External Source CHEMBL
PubChem CID 10458839 Functional Category Bioactive
Molecule Name N-benzyl-2-[4-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-2-(4-fluorophenyl)acetamide
IUPAC Name N-benzyl-2-[4-[3-(2,6-dimethylphenoxy)-2-hydroxypropyl]piperazin-1-yl]-2-(4-fluorophenyl)acetamide
Synonyms CHEBI:197978
InChi InChI=1S/C30H36FN3O3/c1-22-7-6-8-23(2)29(22)37-21-27(35)20-33-15-17-34(18-16-33)28(25-11-13-26(31)14-12-25)30(36)32-19-24-9-4-3-5-10-24/h3-14,27-28,35H,15-21H2,1-2H3,(H,32,36)
InChiKey LZLFVPXCZHSLNT-UHFFFAOYSA-N
Formula C30H36FN3O3 Molecular Weight 505.62
Cross Link CHEMBL305591
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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