CFam Chemical Families Database
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You are searching for "CFAMM00446992" in compound.

Total 1 results found.

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 CFAMM00446992
Family CFFBM18373 Beta-2 adrenergic receptor and Beta-1 adrenergic receptor ligand SureCN9134292 family
Superfamily CFSBM6269 Beta-1 adrenergic receptor and Beta-3 adrenergic receptor Binder Superfamily 3
Class CFCBM1594 Class 4644
External ID CHEMBL553039 External Source CHEMBL
PubChem CID 45260430 Functional Category Bioactive
Molecule Name SureCN9133629
IUPAC Name ethyl 3-[(7S)-7-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]propanoate;hydrochloride
Synonyms CHEBI:645132;SR-58997A
InChi InChI=1S/C23H28ClNO3.ClH/c1-2-28-23(27)11-7-16-6-8-17-9-10-21(14-19(17)12-16)25-15-22(26)18-4-3-5-20(24)13-18;/h3-6,8,12-13,21-22,25-26H,2,7,9-11,14-15H2,1H3;1H/t21-,22-;/m0./s1
InChiKey PWRYMMTWSPKRJD-VROPFNGYSA-N
Formula C23H29Cl2NO3 Molecular Weight 438.39
Cross Link CHEMBL553039
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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