CFam Chemical Families Database
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You are searching for "CFAMM00306984" 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 CFAMM00306984
Family CFFBM90 Beta-3 adrenergic receptor and Beta-1 adrenergic receptor ligand SureCN6074181 family
Superfamily CFSBM62 Beta-3 adrenergic receptor and Beta-1 adrenergic receptor Binder Superfamily
Class CFCCD67 Class 880
External ID CHEMBL284311 External Source CHEMBL
PubChem CID 9803765 Functional Category Bioactive
Molecule Name SureCN6074538
IUPAC Name 4-[4-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(methanesulfonamido)phenyl]ethyl]amino]piperidin-1-yl]benzoic acid
Synonyms CHEBI:148438
InChi InChI=1S/C21H27N3O6S/c1-31(29,30)23-18-12-15(4-7-19(18)25)20(26)13-22-16-8-10-24(11-9-16)17-5-2-14(3-6-17)21(27)28/h2-7,12,16,20,22-23,25-26H,8-11,13H2,1H3,(H,27,28)/t20-/m0/s1
InChiKey PTFVLKKBZGVHRY-FQEVSTJZSA-N
Formula C21H27N3O6S Molecular Weight 449.52
Cross Link CHEMBL284311
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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