CFam Chemical Families Database
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You are searching for "CFAMM00318821" in compound.

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CFAM Mol ID CFAMM00318821
Family CFFBM1053 Beta-1 adrenergic receptor and Beta-2 adrenergic receptor ligand 1-(cyclopropylamino)-3-[4-[5-(trifluoromethyl)-1H-imidazol-2-yl]phenoxy]propan-2-ol family
Superfamily CFSBM599 Beta-1 adrenergic receptor and Beta-2 adrenergic receptor Binder Superfamily 2
Class CFCCD162 Class 975
External ID 15572701 External Source PubChem
PubChem CID 15572701 Functional Category Patent Compound
Molecule Name AGN-PC-00PQ1O
IUPAC Name N-[2-[[3-[4-(1H-benzimidazol-2-yl)phenoxy]-2-hydroxypropyl]amino]ethyl]-2-methylpropanamide
Synonyms SureCN11258032;N-[2-[[3-[4-(1H-benzimidazol-2-yl)phenoxy]-2-hydroxypropyl]amino]ethyl]-2-methylpropanamide
InChi InChI=1S/C22H28N4O3/c1-15(2)22(28)24-12-11-23-13-17(27)14-29-18-9-7-16(8-10-18)21-25-19-5-3-4-6-20(19)26-21/h3-10,15,17,23,27H,11-14H2,1-2H3,(H,24,28)(H,25,26)
InChiKey VKMSUUPWGUPPLD-UHFFFAOYSA-N
Formula C22H28N4O3 Molecular Weight 396.48
Cross Link
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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Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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