CFam Chemical Families Database
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You are searching for "CFAMM00481513" 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 CFAMM00481513
Family CFFBM27135 C-X-C chemokine receptor type 2 ligand 4-[5-cyano-2-(4-fluorophenyl)-6-methoxy-1H-indol-3-yl]-N-(dimethylsulfamoyl)butanamide family
Superfamily CFSBM2820 Melatonin receptor type 1A and Melatonin receptor type 1B Binder Superfamily 4
Class CFCBM25 Class 3075
External ID CHEMBL404088 External Source CHEMBL
PubChem CID 44447924 Functional Category Bioactive
Molecule Name 4-[5-cyano-2-(4-fluorophenyl)-6-methoxy-1H-indol-3-yl]-N-methylsulfonylbutanamide
IUPAC Name 4-[5-cyano-2-(4-fluorophenyl)-6-methoxy-1H-indol-3-yl]-N-methylsulfonylbutanamide
Synonyms CHEBI:524719
InChi InChI=1S/C21H20FN3O4S/c1-29-19-11-18-17(10-14(19)12-23)16(4-3-5-20(26)25-30(2,27)28)21(24-18)13-6-8-15(22)9-7-13/h6-11,24H,3-5H2,1-2H3,(H,25,26)
InChiKey FIOACYLNJGQQFQ-UHFFFAOYSA-N
Formula C21H20FN3O4S Molecular Weight 429.46
Cross Link CHEMBL404088
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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