CFam Chemical Families Database
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You are searching for "CFAMM00442390" 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 CFAMM00442390
Family CFFBM17424 Beta-3 adrenergic receptor and Beta-1 adrenergic receptor ligand 3-[[(7S)-7-[[(2R)-2-(6-chloropyridin-3-yl)-2-hydroxyethyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]benzoic acid family
Superfamily CFSBM837 Histamine H3 receptor and Beta-1 adrenergic receptor Binder Superfamily
Class CFCID302 Class 1652
External ID CHEMBL516002 External Source CHEMBL
PubChem CID 24950568 Functional Category Bioactive
Molecule Name 4-[(7S)-7-[[(2R)-2-(6-chloropyridin-3-yl)-2-hydroxyethyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]benzoic acid
IUPAC Name 4-[(7S)-7-[[(2R)-2-(6-chloropyridin-3-yl)-2-hydroxyethyl]amino]-5,6,7,8-tetrahydronaphthalen-2-yl]benzoic acid
Synonyms CHEBI:612142
InChi InChI=1S/C24H23ClN2O3/c25-23-10-8-19(13-27-23)22(28)14-26-21-9-7-16-3-6-18(11-20(16)12-21)15-1-4-17(5-2-15)24(29)30/h1-6,8,10-11,13,21-22,26,28H,7,9,12,14H2,(H,29,30)/t21-,22-/m0/s1
InChiKey GPISTKPIQBYKBI-VXKWHMMOSA-N
Formula C24H23ClN2O3 Molecular Weight 422.90
Cross Link CHEMBL516002
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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