CFam Chemical Families Database
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You are searching for "CFAMM00442370" 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 CFAMM00442370
Family CFFBM17416 Sodium-dependent noradrenaline transporter inhibitor SureCN4084324 family
Superfamily CFSBM7068 Sodium-dependent noradrenaline transporter and Mineralocorticoid receptor Binder Superfamily
Class CFCCD120 Class 933
External ID CHEMBL603495 External Source CHEMBL
PubChem CID 45139971 Functional Category Bioactive
Molecule Name SureCN4761895
IUPAC Name (1S,2R)-1-(3,3-diethyl-2H-indol-1-yl)-1-(3-fluorophenyl)-3-(methylamino)propan-2-ol;hydrochloride
Synonyms CHEBI:703328
InChi InChI=1S/C22H29FN2O.ClH/c1-4-22(5-2)15-25(19-12-7-6-11-18(19)22)21(20(26)14-24-3)16-9-8-10-17(23)13-16;/h6-13,20-21,24,26H,4-5,14-15H2,1-3H3;1H/t20-,21+;/m1./s1
InChiKey IYXFYMMSRUEOGZ-BHDTVMLSSA-N
Formula C22H30ClFN2O Molecular Weight 392.94
Cross Link CHEMBL603495
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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