CFam Chemical Families Database
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You are searching for "CFAMM00170799" in compound.

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CFAM Mol ID CFAMM00170799
Family CFFCD744 Apricoxib family
Superfamily CFSCD655 Apricoxib Superfamily
Class CFCAD198 Class 198
External ID CHEMBL326937 External Source CHEMBL
PubChem CID 10250472 Functional Category Bioactive
Molecule Name 4-[3-[2-(diethylamino)ethyl]-5-methoxyindol-1-yl]sulfonylaniline
IUPAC Name 4-[3-[2-(diethylamino)ethyl]-5-methoxyindol-1-yl]sulfonylaniline
Synonyms CHEBI:285901;PDSP1_000382;PDSP2_000380
InChi InChI=1S/C21H27N3O3S/c1-4-23(5-2)13-12-16-15-24(21-11-8-18(27-3)14-20(16)21)28(25,26)19-9-6-17(22)7-10-19/h6-11,14-15H,4-5,12-13,22H2,1-3H3
InChiKey BOWVPYNJPNKYGY-UHFFFAOYSA-N
Formula C21H27N3O3S Molecular Weight 401.52
Cross Link CHEMBL326937
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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