CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00072259" 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 CFAMM00072259
Family CFFAD524 Noradrenergic re-uptake Inhibitor Reboxetine Family
Superfamily CFSAD152 monoamine reuptake and receptor binding Fluoxetine Reboxetine Bevantolol Nebivolol Superfamily
Class CFCAD149 Class 149
External ID DAP000720 External Source TTD
PubChem CID 5311403 Functional Category Approved Drug
Molecule Name Reboxetine
IUPAC Name (2R)-2-[(S)-(2-ethoxyphenoxy)-phenylmethyl]morpholine
Synonyms AC1NSKK9;CHEMBL593475;S,S-reboxetine;LS-93003;(2R)-2-[(S)-(2-ethoxyphenoxy)-phenylmethyl]morpholine;SureCN3185544;MolPort-023-221-418;DNC008678;K213;FT-0658685
InChi InChI=1S/C19H23NO3/c1-2-21-16-10-6-7-11-17(16)23-19(15-8-4-3-5-9-15)18-14-20-12-13-22-18/h3-11,18-20H,2,12-14H2,1H3/t18-,19+/m1/s1
InChiKey CBQGYUDMJHNJBX-MOPGFXCFSA-N
Formula C19H23NO3 Molecular Weight 313.39
Cross Link CHEMBL593475
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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