CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00440902" 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.

Search Results

CFAM Mol ID CFAMM00440902
Family CFFBM17175 Sodium-dependent noradrenaline transporter and Sodium-dependent serotonin transporter inhibitor SureCN4866169 family
Superfamily CFSBM7003 Sodium-dependent serotonin transporter and Sodium-dependent noradrenaline transporter Binder Superfamily 6
Class CFCID1684 Class 3034
External ID CHEMBL514937 External Source CHEMBL
PubChem CID 44562816 Functional Category Bioactive
Molecule Name SureCN4864126
IUPAC Name (1S,2R)-1-(3-hydroxy-2-methylphenoxy)-2-(methylaminomethyl)-1,3-dihydroinden-2-ol
Synonyms CHEBI:552585
InChi InChI=1S/C18H21NO3/c1-12-15(20)8-5-9-16(12)22-17-14-7-4-3-6-13(14)10-18(17,21)11-19-2/h3-9,17,19-21H,10-11H2,1-2H3/t17-,18+/m0/s1
InChiKey RPJFGKOZZHLXFS-ZWKOTPCHSA-N
Formula C18H21NO3 Molecular Weight 299.36
Cross Link CHEMBL514937
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
 

 

27518 visits since 2014 .........

 



Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


All rights reserved.

   
 
 
Computer-aided Drug Design
about BIDD |  databases |  software |  teaching |  research |  links

 

Department of Computational Science | National University of Singapore | Blk S17, 3 Science Drive 2, Singapore 117543

hdnkeywordtype:MiniFieldStorage('hdnkeywordtype', 'compound'),None, hdnkeywordtype, compound|txtsearch:MiniFieldStorage('txtsearch', 'CFAMM00440902'),None, txtsearch, CFAMM00440902|