CFam Chemical Families Database
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You are searching for "CFAMM00419244" 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 CFAMM00419244
Family CFFBM12946 Beta-2 adrenergic receptor ligand SureCN4598646 family
Superfamily CFSBM5899 Beta-2 adrenergic receptor and Peroxisome proliferator-activated receptor gamma Binder Superfamily
Class CFCBM122 Class 3172
External ID CHEMBL237501 External Source CHEMBL
PubChem CID 10324803 Functional Category Bioactive
Molecule Name SureCN4598646
IUPAC Name N-[(2,6-dimethoxyphenyl)methyl]-5-[(2R)-2-[[(2R)-2-hydroxy-2-[4-hydroxy-3-(hydroxymethyl)phenyl]ethyl]amino]propyl]-1H-indole-2-carboxamide
Synonyms CHEBI:499874
InChi InChI=1S/C30H35N3O6/c1-18(31-16-27(36)20-8-10-26(35)22(13-20)17-34)11-19-7-9-24-21(12-19)14-25(33-24)30(37)32-15-23-28(38-2)5-4-6-29(23)39-3/h4-10,12-14,18,27,31,33-36H,11,15-17H2,1-3H3,(H,32,37)/t18-,27+/m1/s1
InChiKey WTBGOYCHEVMMHF-CLYVBNDRSA-N
Formula C30H35N3O6 Molecular Weight 533.62
Cross Link CHEMBL237501
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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