CFam Chemical Families Database
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You are searching for "CFAMM00428975" 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 CFAMM00428975
Family CFFBM14540 Beta-3 adrenergic receptor ligand SureCN4584432 family
Superfamily CFSBM6354 Beta-3 adrenergic receptor Binder Superfamily 3
Class CFCAD411 Class 411
External ID CHEMBL551532 External Source CHEMBL
PubChem CID 45271886 Functional Category Bioactive
Molecule Name 4-[4-[(2R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]propyl]phenyl]-2-(2-methylpropyl)-N-methylsulfonylbenzamide
IUPAC Name 4-[4-[(2R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]propyl]phenyl]-2-(2-methylpropyl)-N-methylsulfonylbenzamide
Synonyms CHEBI:664339
InChi InChI=1S/C29H36N2O4S/c1-20(2)16-26-18-25(14-15-27(26)29(33)31-36(4,34)35)23-12-10-22(11-13-23)17-21(3)30-19-28(32)24-8-6-5-7-9-24/h5-15,18,20-21,28,30,32H,16-17,19H2,1-4H3,(H,31,33)/t21-,28+/m1/s1
InChiKey HZBACCFYWKQVGF-PIKZIKFNSA-N
Formula C29H36N2O4S Molecular Weight 508.67
Cross Link CHEMBL551532
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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