CFam Chemical Families Database
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You are searching for "CFAMM00441367" in compound.

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CFAM Mol ID CFAMM00441367
Family CFFBM17252 Beta-3 adrenergic receptor and Beta-1 adrenergic receptor ligand 4-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]-N-methylsulfonyl-2-pentoxybenzamide;hydrochloride family
Superfamily CFSBM1203 Pol polyprotein and Beta-1 adrenergic receptor Binder Superfamily
Class CFCAD322 Class 322
External ID CHEMBL561335 External Source CHEMBL
PubChem CID 42640122 Functional Category Bioactive
Molecule Name 4-[4-[2-[[(2R)-2-(4-aminophenyl)-2-hydroxyethyl]amino]ethyl]phenyl]-N-methylsulfonyl-2-propan-2-yloxybenzamide
IUPAC Name 4-[4-[2-[[(2R)-2-(4-aminophenyl)-2-hydroxyethyl]amino]ethyl]phenyl]-N-methylsulfonyl-2-propan-2-yloxybenzamide
Synonyms CHEBI:657329
InChi InChI=1S/C27H33N3O5S/c1-18(2)35-26-16-22(10-13-24(26)27(32)30-36(3,33)34)20-6-4-19(5-7-20)14-15-29-17-25(31)21-8-11-23(28)12-9-21/h4-13,16,18,25,29,31H,14-15,17,28H2,1-3H3,(H,30,32)/t25-/m0/s1
InChiKey DSYPZNZEDDKOFW-VWLOTQADSA-N
Formula C27H33N3O5S Molecular Weight 511.63
Cross Link CHEMBL561335
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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