CFam Chemical Families Database
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You are searching for "CFAMM00446295" 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 CFAMM00446295
Family CFFBM18278 Beta-1 adrenergic receptor and Beta-3 adrenergic receptor ligand 2-[4-[4-[2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]anilino]phenoxy]acetic acid;hydrochloride family
Superfamily CFSBM7278 Beta-1 adrenergic receptor and Beta-3 adrenergic receptor ligand 2-[4-[4-[2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]anilino]phenoxy]acetic acid;hydrochloride Superfamily
Class CFCBM113 Class 3163
External ID CHEMBL536330 External Source CHEMBL
PubChem CID 24823465 Functional Category Bioactive
Molecule Name 2-[4-[4-[2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]anilino]phenoxy]acetic acid;hydrochloride
IUPAC Name 2-[4-[4-[2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]ethyl]anilino]phenoxy]acetic acid;hydrochloride
Synonyms SureCN4463107
InChi InChI=1S/C24H25ClN2O4.ClH/c25-19-3-1-2-18(14-19)23(28)15-26-13-12-17-4-6-20(7-5-17)27-21-8-10-22(11-9-21)31-16-24(29)30;/h1-11,14,23,26-28H,12-13,15-16H2,(H,29,30);1H/t23-;/m0./s1
InChiKey XCYBZELKWUXYJX-BQAIUKQQSA-N
Formula C24H26Cl2N2O4 Molecular Weight 477.38
Cross Link CHEMBL536330
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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